Structure of PDB 3pzt Chain B Binding Site BS01

Receptor Information
>3pzt Chain B (length=296) Species: 224308 (Bacillus subtilis subsp. subtilis str. 168) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VAKNGQLSIKGTQLVNRDGKAVQLKGISSHGLQWYGEYVNKDSLKWLRDD
WGITVFRAAMYTADGGYIDNPSVKNKVKEAVEAAKELGIYVIIDWHILND
GNPNQNKEKAKEFFKEMSSLYGNTPNVIYEIANEPNGDVNWKRDIKPYAE
EVISVIRKNDPDNIIIVGTGTWSQDVNDAADDQLKDANVMYALHFYAGTH
GQFLRDKANYALSKGAPIFVTEWGTSDASGNGGVFLDQSREWLKYLDSKT
ISWVNWNLSDKQESSSALKPGASKTGGWRLSDLSASGTFVRENILG
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain3pzt Chain B Residue 2 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3pzt Dissecting structure-function-stability relationships of a thermostable GH5-CBM3 cellulase from Bacillus subtilis 168.
Resolution1.97 Å
Binding residue
(original residue number in PDB)		G157 D195 D197 N198
Binding residue
(residue number reindexed from 1)		G122 D160 D162 N163
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.4: cellulase.
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
Biological Process
GO:0000272 polysaccharide catabolic process
GO:0005975 carbohydrate metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:3pzt, PDBe:3pzt, PDBj:3pzt
PDBsum3pzt
PubMed21880019
UniProtP10475|GUN2_BACSU Endoglucanase (Gene Name=eglS)

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