{ "Version": "1.1.23.12.27b", "Errors": {}, "ValidationType": "Database", "MotiveCount": 6946, "Models": [ { "ModelName": "FAD", "LongName": "flavin-adenine dinucleotide", "Formula": "C{27}H{33}N{9}O{15}P{2}", "CoordinateSource": "CifModel", "ModelNames": { "1": "PA", "2": "O1A", "3": "O2A", "4": "O5B", "5": "C5B", "6": "C4B", "7": "O4B", "8": "C3B", "9": "O3B", "10": "C2B", "11": "O2B", "12": "C1B", "13": "N9A", "14": "C8A", "15": "N7A", "16": "C5A", "17": "C6A", "18": "N6A", "19": "N1A", "20": "C2A", "21": "N3A", "22": "C4A", "23": "N1", "24": "C2", "25": "O2", "26": "N3", "27": "C4", "28": "O4", "29": "C4X", "30": "N5", "31": "C5X", "32": "C6", "33": "C7", "34": "C7M", "35": "C8", "36": "C8M", "37": "C9", "38": "C9A", "39": "N10", "40": "C10", "41": "C1'", "42": "C2'", "43": "O2'", "44": "C3'", "45": "O3'", "46": "C4'", "47": "O4'", "48": "C5'", "49": "O5'", "50": "P", "51": "O1P", "52": "O2P", "53": "O3P" }, "ModelAtomTypes": { "1": "P", "2": "O", "3": "O", "4": "O", "5": "C", "6": "C", "7": "O", "8": "C", "9": "O", "10": "C", "11": "O", "12": "C", "13": "N", "14": "C", "15": "N", "16": "C", "17": "C", "18": "N", "19": "N", "20": "C", "21": "N", "22": "C", "23": "N", "24": "C", "25": "O", "26": "N", "27": "C", "28": "O", "29": "C", "30": "N", "31": "C", "32": "C", "33": "C", "34": "C", "35": "C", "36": "C", "37": "C", "38": "C", "39": "N", "40": "C", "41": "C", "42": "C", "43": "O", "44": "C", "45": "O", "46": "C", "47": "O", "48": "C", "49": "O", "50": "P", "51": "O", "52": "O", "53": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 6, 8, 10, 12, 42, 44, 46, 50 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 6, 8, 10, 12, 42, 44, 46 ], "Metal": [], "NonSingleBond": [ 1, 50 ] }, "AtomNamingEquivalence": { "Charge": { "C7M": "C7M", "C8M": "C7M", "HM71": "HM71", "HM72": "HM71", "HM73": "HM71", "HM81": "HM71", "HM82": "HM71", "HM83": "HM71", "H1'1": "H1'1", "H1'2": "H1'1", "H5'1": "H5'1", "H5'2": "H5'1", "H51A": "H5'1", "H52A": "H5'1", "H3B": "H3B", "H4B": "H3B", "H61A": "H61A", "H62A": "H61A", "HO2'": "HO2'", "HO3'": "HO2'", "HO3A": "HO2'", "HO4'": "HO2'", "HOA2": "HOA2", "HOP2": "HOA2", "O2A": "O2A", "O2P": "O2A", "O5'": "O5'", "O5B": "O5'", "O1A": "O1A", "O1P": "O1A", "P": "P", "PA": "P" }, "ChargeIgnoreBondTypes": { "C7M": "C7M", "C8M": "C7M", "O3B": "O3B", "O4'": "O3B", "O1A": "O1A", "O1P": "O1A", "O2A": "O1A", "O2P": "O1A", "P": "P", "PA": "P" } }, "ModelBonds": { "1-2": 2, "1-3": 1, "1-4": 1, "1-53": 1, "4-5": 1, "5-6": 1, "6-7": 1, "6-8": 1, "7-12": 1, "8-9": 1, "8-10": 1, "10-11": 1, "10-12": 1, "12-13": 1, "13-14": 1, "13-22": 1, "14-15": 2, "15-16": 1, "16-17": 1, "16-22": 2, "17-18": 1, "17-19": 2, "19-20": 1, "20-21": 2, "21-22": 1, "23-24": 1, "23-40": 2, "24-25": 2, "24-26": 1, "26-27": 1, "27-28": 2, "27-29": 1, "29-30": 2, "29-40": 1, "30-31": 1, "31-32": 2, "31-38": 1, "32-33": 1, "33-34": 1, "33-35": 2, "35-36": 1, "35-37": 1, "37-38": 2, "38-39": 1, "39-40": 1, "39-41": 1, "41-42": 1, "42-43": 1, "42-44": 1, "44-45": 1, "44-46": 1, "46-47": 1, "46-48": 1, "48-49": 1, "49-50": 1, "50-51": 2, "50-52": 1, "50-53": 1 }, "Summary": { "Analyzed": 6946, "HasAll": 6854, "HasAll_BadChirality": 1977, "HasAll_BadChirality_Carbon": 90, "HasAll_BadChirality_Metal": 0, "HasAll_BadChirality_NonSingleBond": 1912, "HasAll_BadChirality_Other": 0, "HasAll_BadChirality_Planar": 0, "HasAll_Foreign": 1, "HasAll_GoodChirality": 4877, "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors": 6764, "HasAll_NameMismatch": 4250, "HasAll_NameMismatch_ChargeEquiv": 0, "HasAll_NameMismatch_ChargeEquivIgnoreBondType": 4250, "HasAll_NameMismatch_NonChargeEquiv": 4250, "HasAll_NameMismatch_NonChargeEquivIgnoreBondType": 0, "HasAll_Substitutions": 0, "HasAll_WrongBonds": 0, "HasAll_ZeroRmsd": 1, "Has_AlternateLocation": 41, "Has_NamingIssue_Duplicates": 0, "Has_NamingIssue_NonBoundarySubstitutionOrForeign": 1, "Has_NamingIssue_NonIsomorphic": 13, "Missing": 92, "Missing_Atoms": 16, "Missing_Degenerate": 19, "Missing_Rings": 57, 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"4p8h", "4p8k", "4p8l", "4p8m", "4p8n", "4p8p", "4p8t", "4p8y", "4p9s", "4paa", "4pab", "4pfa", "4pfd", "4pve", "4pvh", "4pvj", "4pvk", "4pwb", "4pwc", "4pyt", "4pzf", "4q71", "4q72", "4q73", "4qfc", "4qfd", "4qi4", "4qi5", "4qi6", "4qi7", "4qoe", "4qog", "4qoh", "4r82", "4rek", "4rep", "4rg3", "4rg4", "4rpg", "4rph", "4rpj", "4rpk", "4rpl", "4rsl", "4tlz", "4tm0", "4tm3", "4txi", "4txk", "4u2t", "4u63", "4u7f", "4u7g", "4u7h", "4u9u", "4uaj", "4ud8", "4udp", "4udq", "4udr", "4uhw", "4uhx", "4uir", "4up3", "4usq", "4usr", "4uxn", "4wct", "4wqm", "4x4j", "4x9m", "4x9n", "4xbf", "4xdg", "4xdh", "4xdt", "4xlo", "4xvg", "4xwr", "4xwz", "4xxg", "4y7c", "4y9j", "4y9l", "4y9r", "4y9u", "4yaf", "4yal", "4yao", "4yau", "4yaw", "4ybn", "4yhb", "4yjd", "4yjf", "4yjg", "4yjh", "4ykf", "4ykg", "4ylf", "4ynu", "4yrw", "4yry", "4ysh", "4ysw", "4ysx", "4ysy", "4ysz", "4yt0", "4ytm", "4ytn", "4ytp", "4yty", "4ytz", "4ywo", "4yxd", "4z24", "4z25", "4z26", "4z2r", "4z2t", "4z2u", "4z43", "4z44", "4zcc", 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"5u25", "5u63", "5u8u", "5u8v", "5u8w", "5uao", "5ue9", "5ufa", "5ume", "5urd", "5ure", "5urg", "5urh", "5uri", "5usx", "5uth", "5uwy", "5ux5", "5v36", "5vdn", "5vj7", "5vn0", "5voh", "5vpn", "5vqb", "5vt3", "5vw3", "5vw4", "5vw5", "5vw6", "5vw8", "5vw9", "5vwa", "5vwb", "5vwt", "5vwu", "5w1j", "5w1l", "5w4c", "5wed", "5wgr", "5wgs", "5wgt", "5wgu", "5wgv", "5wgw", "5wgx", "5wgy", "5wgz", "5wj1", "5wkc", "5wwv", "5wx2", "5x1y", "5x60", "5x68", "5x6p", "5x6q", "5x6r", "5xao", "5xgv", "5xhu", "5xki", "5xmj", "5xtn", "5xto", "5xtp", "5xtq", "5xtr", "5y66", "5y6q", "5y77", "5y7a", "5y9d", "5yb6", "5yb7", "5yb8", "5ygq", "5yjb", "5yjw", "5yjx", "5yjy", "5yly", "5ys9", "5z2g", "5z8t", "5zbc", "5zbd", "5zcw", "5zj9", "5zja", "5zm0", "5zu2", "5zw2", "5zw7", "5zw8", "5zyn", "6a2u", "6a37", "6a4j", "6a6r", "6a6s", "6a6t", "6a6u", "6a6v", "6a7x", "6abu", "6ac1", "6ac4", "6ad4", "6adj", "6af6", "6ain", "6aju", "6aon", "6awa", "6awf", "6b4o", "6b58", "6bd3", "6bd9", "6bdo", "6bpy", "6brd", "6btl", "6bu7", "6bz0", "6bza", "6bzq", "6bzt", "6bzz", "6c12", "6c6n", "6c6p", "6c6r", "6c71", "6c7s", "6c80", "6cmz", "6cr0", "6cxt", "6cy8", "6d2e", "6d99", "6d9b", "6d9d", "6dd6", "6dek", "6del", "6dem", "6den", "6deo", "6dep", "6deq", "6der", "6des", "6dll", "6du7", "6eci", "6efv", "6em0", "6eo4", "6eo5", "6er5", "6er9", "6era", "6es9", "6esd", "6f32", "6f72", "6f73", "6f74", "6f7l", "6f7v", "6f97", "6fah", "6fcx", "6fho", "6fjh", "6fmu", "6fmz", "6fn0", "6fn2", "6fn3", "6fnu", "6foq", "6fow", "6fox", "6foy", "6foz", "6fp0", "6fp1", "6fp3", "6fp4", "6fph", "6ftc", "6fvz", "6fw0", "6fw7", "6fw8", "6fw9", "6fwa", "6fwc", "6fy4", "6fy8", "6fy9", "6fya", "6fyb", "6fyc", "6fyd", "6fye", "6fyf", "6fyg", "6g2p", "6g83", "6gar", "6gas", "6geh", "6gg2", "6gna", "6gnb", "6gnc", "6gnd", "6gou", "6gqi", "6h3g", "6h3o", "6haf", "6hcy", "6hd1", "6hez", "6hf0", "6hf3", "6hfv", "6hfw", "6hg8", "6hns", "6i4p", "6i4q", "6i4r", "6i4s", "6i4t", "6i4u", "6i4z", "6i7n", "6ici", "6iwe", "6j0z", "6j38", "6j39", 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"HasAll_NameMismatch", "HasAll_NameMismatch_ChargeEquivIgnoreBondType", "HasAll_NameMismatch_NonChargeEquiv" ], "MainResidue": "FAD 401 B", "ResidueCount": 1, "Residues": [ "FAD 401 B" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 2, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "51": "O2P O 8553", "52": "O1P O 8552" }, "NameMismatchFlags": { "52": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ], "51": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ] }, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 3.382 }, { "ModelName": "FAD", "Id": "9xub_2_8555", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors", "HasAll_NameMismatch", "HasAll_NameMismatch_ChargeEquivIgnoreBondType", "HasAll_NameMismatch_NonChargeEquiv" ], "MainResidue": "FAD 401 C", "ResidueCount": 1, "Residues": [ "FAD 401 C" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 2, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "51": "O2P O 8606", "52": "O1P O 8605" }, "NameMismatchFlags": { "52": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ], "51": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ] }, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 0.417 }, { "ModelName": "FAD", "Id": "9xub_3_8608", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors", "HasAll_NameMismatch", "HasAll_NameMismatch_ChargeEquivIgnoreBondType", "HasAll_NameMismatch_NonChargeEquiv" ], "MainResidue": "FAD 401 D", "ResidueCount": 1, "Residues": [ "FAD 401 D" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 2, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "51": "O2P O 8659", "52": "O1P O 8658" }, "NameMismatchFlags": { "52": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ], "51": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ] }, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 0.395 }, { "ModelName": "FAD", "Id": "9yjz_1_9007", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_BadChirality", "HasAll_BadChirality_Carbon", "HasAll_NameMismatch", "HasAll_NameMismatch_ChargeEquivIgnoreBondType", "HasAll_NameMismatch_NonChargeEquiv" ], "MainResidue": "FAD 803 A", "ResidueCount": 1, "Residues": [ "FAD 803 A" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 2, "ForeignAtomCount": 0, "ChiralityMismatchCount": 3, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "51": "O2P O 9058", "52": "O1P O 9057" }, "NameMismatchFlags": { "52": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ], "51": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ] }, "ForeignAtoms": {}, "ChiralityMismatches": { "6": "C4B C 9012", "42": "C2' C 9048", "46": "C4' C 9052" }, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 2.903 }, { "ModelName": "FAD", "Id": "9yjz_3_9134", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_BadChirality", "HasAll_BadChirality_Carbon", "HasAll_NameMismatch", "HasAll_NameMismatch_ChargeEquivIgnoreBondType", "HasAll_NameMismatch_NonChargeEquiv" ], "MainResidue": "FAD 803 B", "ResidueCount": 1, "Residues": [ "FAD 803 B" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 2, "ForeignAtomCount": 0, "ChiralityMismatchCount": 3, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "51": "O2P O 9185", "52": "O1P O 9184" }, "NameMismatchFlags": { "52": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ], "51": [ "ChargeEquivIgnoreBonds", "NonChargeEquiv" ] }, "ForeignAtoms": {}, "ChiralityMismatches": { "6": "C4B C 9139", "42": "C2' C 9175", "46": "C4' C 9179" }, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 2.966 }, { "ModelName": "FAD", "Id": "9yk0_1_8904", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "FAD 803 A", "ResidueCount": 1, "Residues": [ "FAD 803 A" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 2.787 }, { "ModelName": "FAD", "Id": "9yk0_4_9012", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "FAD 803 B", "ResidueCount": 1, "Residues": [ "FAD 803 B" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 0, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [], "ModelRmsd": 2.778 } ], "Warnings": { "5kwf": [ "Residue FAD 601 A: Skipped alternate location(s) 'B'." ], "5kwf_0_8460": [ "Residue FAD 601 A: Skipped alternate location(s) 'B'." ], "1dob": [ "Residue FAD 395 A: Skipped alternate location(s) 'B'." ], "1dob_0_3124": [ "Residue FAD 395 A: Skipped alternate location(s) 'B'." ], "1doe": [ "Residue FAD 395 A: Skipped alternate location(s) 'B'." ], "1doe_0_3128": [ "Residue FAD 395 A: Skipped alternate location(s) 'B'." ], "1ffu_3_18849": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond C2' C 18890-O3' O 18893 (1.653 ang), extra bond C3' C 18892-O4' O 18895 (1.626 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "1ffu_7_18935": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond C2' C 18976-O3' O 18979 (1.697 ang), extra bond C3' C 18978-O4' O 18981 (1.683 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "1ffv_3_18880": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond C2' C 18921-O3' O 18924 (1.613 ang), extra bond C3' C 18923-O4' O 18926 (1.637 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "1ffv_7_18989": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond C2' C 19030-O3' O 19033 (1.610 ang), extra bond C3' C 19032-O4' O 19035 (1.619 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "1h42": [ "Residue FAD 1304 A: Skipped alternate location(s) 'B'." ], "1h42_0_2337": [ "Residue FAD 1304 A: Skipped alternate location(s) 'B'." ], "7npa": [ "Residue FAD 1009 N: 'FAD 1001 N' and 'FAD 1009 N' are too close to each other (0.240 ang). 'FAD 1009 N' ignored." ], "1zy8": [ "Line 50864: Only the first model was loaded (the input contains multiple models)." ], "1onf_0_3458": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond C5A C 3473-C4A C 3478 (1.383 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "4h6q": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'.", "Residue FAD 2001 C: Skipped alternate location(s) 'B'." ], "4h6q_0_4383": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'." ], "4h6q_2_4503": [ "Residue FAD 2001 C: Skipped alternate location(s) 'B'." ], "2bun": [ "Line 4144: Only the first model was loaded (the input contains multiple models)." ], "2c4c": [ "Residue FAD 600 B: Skipped alternate location(s) 'B'." ], "2c4c_1_7497": [ "Residue FAD 600 B: Skipped alternate location(s) 'B'." ], "1r2j_0_2571": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond O5' O 2619-O1P O 2621 (1.591 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "2pdr": [ "Residue FAD 201 A: Skipped alternate location(s) 'B'.", "Residue FAD 202 B: Skipped alternate location(s) 'B'.", "Residue FAD 203 C: Skipped alternate location(s) 'B'.", "Residue FAD 204 D: Skipped alternate location(s) 'B'." ], "2pdr_0_4989": [ "Residue FAD 201 A: Skipped alternate location(s) 'B'." ], "2pdr_1_5095": [ "Residue FAD 202 B: Skipped alternate location(s) 'B'." ], "2pdr_2_5201": [ "Residue FAD 203 C: Skipped alternate location(s) 'B'." ], "2pdr_3_5307": [ "Residue FAD 204 D: Skipped alternate location(s) 'B'." ], "2q4w": [ "Line 9189: Only the first model was loaded (the input contains multiple models)." ], "6x0i": [ "Residue FAD 602 C: Skipped alternate location(s) 'B'." ], "6x0i_4_14250": [ "Residue FAD 602 C: Skipped alternate location(s) 'B'." ], "3w5h": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "3w5h_0_3580": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "5thx": [ "Residue FAD 303 A: Skipped alternate location(s) 'B'." ], "5thx_1_2142": [ "Residue FAD 303 A: Skipped alternate location(s) 'B'." ], "9dl2": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'.", "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl2_0_18021": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'." ], "9dl2_6_18237": [ "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl3": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'.", "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl3_0_17787": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'." ], "9dl3_12_18026": [ "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl6": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'.", "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl6_0_18270": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'." ], "9dl6_9_18524": [ "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl9": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'.", "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9dl9_0_18178": [ "Residue FAD 2001 A: Skipped alternate location(s) 'B'." ], "9dl9_6_18386": [ "Residue FAD 2001 B: Skipped alternate location(s) 'B'." ], "9e0a": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'.", "Residue FAD 1301 B: Skipped alternate location(s) 'B'." ], "9e0a_0_18118": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "9e0a_4_18311": [ "Residue FAD 1301 B: Skipped alternate location(s) 'B'." ], "9e0c": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'.", "Residue FAD 1301 B: Skipped alternate location(s) 'B'." ], "9e0c_0_18097": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "9e0c_5_18301": [ "Residue FAD 1301 B: Skipped alternate location(s) 'B'." ], "5gv8": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "5gv8_0_4038": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "6net": [ "Residue FAD 2203 B: Skipped alternate location(s) 'B'." ], "6net_4_13555": [ "Residue FAD 2203 B: Skipped alternate location(s) 'B'." ], "9fd4": [ "Residue FAD 201 C: Skipped alternate location(s) 'B'.", "Residue FAD 201 D: Skipped alternate location(s) 'B'." ], "9fd4_4_10479": [ "Residue FAD 201 C: Skipped alternate location(s) 'B'." ], "9fd4_6_10919": [ "Residue FAD 201 D: Skipped alternate location(s) 'B'." ], "9fd5": [ "Residue FAD 201 D: Skipped alternate location(s) 'B'." ], "9fd5_6_11118": [ "Residue FAD 201 D: Skipped alternate location(s) 'B'." ], "9fd6": [ "Residue FAD 201 C: Skipped alternate location(s) 'B'." ], "9fd6_4_10317": [ "Residue FAD 201 C: Skipped alternate location(s) 'B'." ], "7w3o": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'.", "Residue FAD 1301 B: Skipped alternate location(s) 'B'.", "Residue FAD 1301 C: Skipped alternate location(s) 'B'.", "Residue FAD 1301 D: Skipped alternate location(s) 'B'." ], "7w3o_0_10762": [ "Residue FAD 1301 A: Skipped alternate location(s) 'B'." ], "7w3o_1_10835": [ "Residue FAD 1301 B: Skipped alternate location(s) 'B'." ], "7w3o_2_10908": [ "Residue FAD 1301 C: Skipped alternate location(s) 'B'." ], "7w3o_3_10981": [ "Residue FAD 1301 D: Skipped alternate location(s) 'B'." ], "7xe2": [ "Residue FAD 906 A: 'FAD 904 A' and 'FAD 906 A' are too close to each other (0.337 ang). 'FAD 906 A' ignored.", "Residue FAD 906 B: 'FAD 904 B' and 'FAD 906 B' are too close to each other (0.202 ang). 'FAD 906 B' ignored." ], "9r52_2_14251": [ "FAD: Model/Input Motif bond discrepancy: different bond count, extra bond O3P O 14303-O O 14865 (1.588 ang). Likely causes: 1) Degenerate motif (i.e. misplaced atoms), 2) Wrong CONECT record(s) in the parent PDB (if PDB format was used)." ], "9v6a": [ "Residue FAD 301 A: Skipped alternate location(s) 'B'." ], "9v6a_0_3848": [ "Residue FAD 301 A: Skipped alternate location(s) 'B'." ], "9v6b": [ "Residue FAD 301 A: Skipped alternate location(s) 'B'." ], "9v6b_0_4916": [ "Residue FAD 301 A: Skipped alternate location(s) 'B'." ] }, "Errors": {} } ] }