Structure of PDB 6z2h Chain A Binding Site BS02

Receptor Information
>6z2h Chain A (length=264) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SHMKPASFMTSICDERGQELIYAGMPITEVFKEEMGIGGVLGLLWFQKRL
PKYSCQFIEMCLMVTADHGPAVSGAHNTIICARAGKDLVSSLTSGLLTIG
DRFGGALDAAAKMFSKAFDSGIIPMEFVNKMKKEGKLIMGIGHRVKSINN
PDMRVQILKDYVRQHFPATPLLDYALEVEKITTSKKPNLILNVDGLIGVA
FVDMLRNCGSFTREEADEYIDIGALNGIFVLGRSMGFIGHYLDQKRLKQG
LYRHPWDDISYVLP
Ligand information
Ligand IDOAA
InChIInChI=1S/C4H4O5/c5-2(4(8)9)1-3(6)7/h1H2,(H,6,7)(H,8,9)/p-1
InChIKeyKHPXUQMNIQBQEV-UHFFFAOYSA-M
SMILES
SoftwareSMILES
ACDLabs 10.04[O-]C(=O)CC(=O)C(=O)O
OpenEye OEToolkits 1.5.0C(C(=O)C(=O)O)C(=O)[O-]
CACTVS 3.341OC(=O)C(=O)CC([O-])=O
FormulaC4 H3 O5
NameOXALOACETATE ION
ChEMBL
DrugBankDB02637
ZINC
PDB chain6z2h Chain A Residue 1202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6z2h Acetyl-CoA is produced by the citrate synthase homology module of ATP-citrate lyase.
Resolution1.8 Å
Binding residue
(original residue number in PDB)		H900 V904 H975 R986 R1065
Binding residue
(residue number reindexed from 1)		H68 V72 H143 R154 R233
Annotation score5
Enzymatic activity
Enzyme Commision number 2.3.3.8: ATP citrate synthase.
Gene Ontology
Molecular Function
GO:0046912 acyltransferase activity, acyl groups converted into alkyl on transfer

View graph for
Molecular Function
External links
PDB RCSB:6z2h, PDBe:6z2h, PDBj:6z2h
PDBsum6z2h
PubMed34294920
UniProtP53396|ACLY_HUMAN ATP-citrate synthase (Gene Name=ACLY)

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