Structure of PDB 7v3n Chain A Binding Site BS03
Receptor Information
>7v3n Chain A (length=317) Species:
249581
(Streptomyces ossamyceticus) [
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EIRRGRIYRDVYHKRVDEEPVDRTADLERARLGDDGLDFQDDAAQARAFA
QGVFLLEIPEWLDLSAGDRFARQFFQGTGVEPYGKYRDLSSEHFGDELLG
YHSRVDQLEQFLLERRFWGEVYPSEIATLGEHLTLLSHRVLRSVLASAGI
PEEDWHRASGGCSETNGSYHLTFNHYRSAHQDIGLSSHKDDGFITVLRTT
AQGLEVNRDDVWEKVPVDPACFVVNFGLSMEILTSACVTPLSAIMHRVSH
QNFDRSSFGHFSSSRCLPGADDGIYRYLPSAGLERVCGSRELIEENAHEI
YMGTEGQGLEHHHHHHH
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
7v3n Chain A Residue 1403 [
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Receptor-Ligand Complex Structure
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PDB
7v3n
The complex structure of SoBcmB mutant D307A and its substrate
Resolution
1.85001 Å
Binding residue
(original residue number in PDB)
N184 Y186 L195 H198 L207 H256 V258 R265 S267 F271
Binding residue
(residue number reindexed from 1)
N174 Y176 L185 H188 L197 H246 V248 R255 S257 F261
Annotation score
4
External links
PDB
RCSB:7v3n
,
PDBe:7v3n
,
PDBj:7v3n
PDBsum
7v3n
PubMed
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