Structure of PDB 2fgn Chain A Binding Site BS01

Receptor Information
>2fgn Chain A (length=243) Species: 1396 (Bacillus cereus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
WSAEDKHKEGVNSHLWIVNRAIDIMSRNTTLVKQDRVAQLNEWRTELENG
IYAADTENPYYDNSTFASHFYDPDNGKTYIPFAKQAKETGAKYFKLAGES
YKNKDMKQAFFYLGLSLHYLGDVNQPMHAANFTNLSYPQGFHSKYENFVD
TIKDNYKVTDGNGYWNWKGTNPEEWIHGAAVVAKQDYSGIVNDNTKDWFV
KAAVSQEYADKWRAEVTPMTGKRLMDAQRVTAGYIQLWFDTYG
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 chain2fgn Chain A Residue 246 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB2fgn Structural studies examining the substrate specificity profiles of PC-PLC(Bc) protein variants.
Resolution2.04 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

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:2fgn, PDBe:2fgn, PDBj:2fgn
PDBsum2fgn
PubMed17324372
UniProtP09598|PHLC_BACCE Phospholipase C (Gene Name=plc)

[Back to BioLiP]