2025-09-06_00000064
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ligand
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9GNF
A novel aminotransferase from Streptomyces sp. Gabaculine complex;
X-ray diffraction 1.31Å
Protein #1
465 residues (98% resolved)
Raw Sequence ...
MGNPIAVSKDLSRTAYDHLWMHFTRMSSYESAPVPTIVRGEGTYIFDDQGRRYLDGLAGLFVVQAGHGRTELAEAASKQAQDLAFFPIWSYAHPKAVELAERLAHEAPGDLNKVFFTTGGGEAVETAWKLAKQYFKLTGKPTKHKVISRAVAYHGTPQGALSITGLPALKAPFEPLVPGAHKVPNTNIYRAPLFGDDPEAFGRWAADQIEQQILFEGPETVAAVFLEPVQNAGGCFPPPPGYFQRVREICDQYDVLLVSDEVICAFGRLGTTFACDKFGYVPDMITCAKGMTSGYSPIGACIISDRLAEPFYQGDNTFLHGYTFGGHPVSSAVALANLDIFDREGLNQHVLDNEGTFFATLQKLHDLPIVGDVRGNGFFYGIELVKDKATKETFTEEETERVLYGFLSKALFDNGLYCRADDRGDPVIQLAPPLISDQSTFDEIEGILRTVLTEAWTKLHHHHHH
Canonical Sequence ...
MGNPIAVSKDLSRTAYDHLWMHFTRMSSYESAPVPTIVRGEGTYIFDDQGRRYLDGLAGLFVVQAGHGRTELAEAASKQAQDLAFFPIWSYAHPKAVELAERLAHEAPGDLNKVFFTTGGGEAVETAWKLAKQYFKLTGKPTKHKVISRAVAYHGTPQGALSITGLPALKAPFEPLVPGAHKVPNTNIYRAPLFGDDPEAFGRWAADQIEQQILFEGPETVAAVFLEPVQNAGGCFPPPPGYFQRVREICDQYDVLLVSDEVICAFGRLGTTFACDKFGYVPDMITCAKGMTSGYSPIGACIISDRLAEPFYQGDNTFLHGYTFGGHPVSSAVALANLDIFDREGLNQHVLDNEGTFFATLQKLHDLPIVGDVRGNGFFYGIELVKDKATKETFTEEETERVLYGFLSKALFDNGLYCRADDRGDPVIQLAPPLISDQSTFDEIEGILRTVLTEAWTKLHHHHHH
Non polymer #2
CA
InChI=1S/Ca/q+2
InChI=1S/Ca/q+2
SMILES: [Ca+2]
[Ca+2]
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #4
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #5
PEG
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
SMILES: C(COCCO)O
C(COCCO)O
Non polymer #6
PXG
InChI=1S/C15H17N2O7P/c1-9-14(18)13(11(6-16-9)8-24-25(21,22)23)7-17-12-4-2-3-10(5-12)15(19)20/h2-6,17-18H,7-8H2,1H3,(H,19,20)(H2,21,22,23)
InChI=1S/C15H17N2O7P/c1-9-14(18)13(11(6-16-9)8-24-25(21,22)23)7-17-12-4-2-3-10(5-12)15(19)20/h2-6,17-18H,7-8H2,1H3,(H,19,20)(H2,21,22,23)
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)CNc2cccc(c2)C(=O)O)O
Cc1c(c(c(cn1)COP(=O)(O)O)CNc2cccc(c2)C(=O)O)O
Biounit #1
homo-dimer
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Model
Reference
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