Structure of PDB 7v2t Chain A Binding Site BS01
Receptor Information
>7v2t Chain A (length=280) Species:
249581
(Streptomyces ossamyceticus) [
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RTADLERARLGDDGLDFQDDAAQARAFAQGVFLLEIPEWLDLSAGDRFAR
QFFQGTGVEPYGKYRDLSSEHFGDELLGYHSRVDQLEQFLLERRFWGEVY
PSEIATLGEHLTLLSHRVLRSVLASAGIPEEDWHRASGGCSETNGSYHLT
FNHYRSAHQDIGLSSHKDDGFITVLRTTAQGLEVNRDDVWEKVPVDPACF
VVNFGLSMEILTSACVTPLSAIMHRVSHQNFDRSSFGHFSSSRCLPGADD
GIYRYLPSAGLERVCGSRELIEENDHEIYM
Ligand information
Ligand ID
AKG
InChI
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
InChIKey
KPGXRSRHYNQIFN-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O=C(O)C(=O)CCC(=O)O
OpenEye OEToolkits 1.7.6
C(CC(=O)O)C(=O)C(=O)O
CACTVS 3.385
OC(=O)CCC(=O)C(O)=O
Formula
C5 H6 O5
Name
2-OXOGLUTARIC ACID
ChEMBL
CHEMBL1686
DrugBank
DB08845
ZINC
ZINC000001532519
PDB chain
7v2t Chain A Residue 1301 [
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Receptor-Ligand Complex Structure
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PDB
7v2t
The complex structure of SoBcmB and its its natural precursor 2
Resolution
2.20006 Å
Binding residue
(original residue number in PDB)
N184 Y186 L195 H198 V258 R265 S267 F271
Binding residue
(residue number reindexed from 1)
N152 Y154 L163 H166 V226 R233 S235 F239
Annotation score
4
External links
PDB
RCSB:7v2t
,
PDBe:7v2t
,
PDBj:7v2t
PDBsum
7v2t
PubMed
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