Structure of PDB 5nrm Chain B Binding Site BS01

Receptor Information
>5nrm Chain B (length=66) Species: 35830 (Acetivibrio cellulolyticus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KPGDVDGNGSINSIDFALMRNYLLGNLKDFPAEDDIKAGDLNGDKSININ
DFAIMRMYLLGMITKF
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain5nrm Chain B Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5nrm Structure-function analyses generate novel specificities to assemble the components of multienzyme bacterial cellulosome complexes.
Resolution1.4 Å
Binding residue
(original residue number in PDB)		D7 D9 N11 S13 D18
Binding residue
(residue number reindexed from 1)		D4 D6 N8 S10 D15
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0046872 metal ion binding
Biological Process
GO:0000272 polysaccharide catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:5nrm, PDBe:5nrm, PDBj:5nrm
PDBsum5nrm
PubMed29367338
UniProtA0A2R2JFJ7

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