Structure of PDB 1ah7 Chain A Binding Site BS01

Receptor Information
>1ah7 Chain A (length=245) Species: 1396 (Bacillus cereus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
WSAEDKHKEGVNSHLWIVNRAIDIMSRNTTLVKQDRVAQLNEWRTELENG
IYAADYENPYYDNSTFASHFYDPDNGKTYIPFAKQAKETGAKYFKLAGES
YKNKDMKQAFFYLGLSLHYLGDVNQPMHAANFTNLSYPQGFHSKYENFVD
TIKDNYKVTDGNGYWNWKGTNPEEWIHGAAVVAKQDYSGIVNDNTKDWFV
KAAVSQEYADKWRAEVTPMTGKRLMDAQRVTAGYIQLWFDTYGDR
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain1ah7 Chain A Residue 246 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1ah7 High-resolution (1.5 A) crystal structure of phospholipase C from Bacillus cereus.
Resolution1.501 Å
Binding residue
(original residue number in PDB)		D55 H69 H118 D122
Binding residue
(residue number reindexed from 1)		D55 H69 H118 D122
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H14 D55 H69 H118 D122 H128 H142 E146
Catalytic site (residue number reindexed from 1) H14 D55 H69 H118 D122 H128 H142 E146
Enzyme Commision number 3.1.4.3: phospholipase C.
Gene Ontology
Molecular Function
GO:0004629 phospholipase C activity
GO:0008270 zinc ion binding
GO:0016787 hydrolase activity
GO:0016788 hydrolase activity, acting on ester bonds
GO:0034480 phosphatidylcholine phospholipase C activity
GO:0046872 metal ion binding
Biological Process
GO:0031640 killing of cells of another organism

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Molecular Function
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Biological Process
External links
PDB RCSB:1ah7, PDBe:1ah7, PDBj:1ah7
PDBsum1ah7
PubMed2493587
UniProtP09598|PHLC_BACCE Phospholipase C (Gene Name=plc)

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