Structure of PDB 1zv9 Chain A Binding Site BS01

Receptor Information
>1zv9 Chain A (length=172) Species: 35830 (Acetivibrio cellulolyticus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
APTSSIEIVLDKTTASVGEIVTASINIKNITNFSGCQLNMKYDPAVLQPV
TSSGVAYTKSTMPGAGTILNSDFNLRQVADNDLEKGILNFSKAYVSLDDY
RTAAAPEQTGTVAVVKFKVLKEETSSISFEDTTSVPNAIDGTVLFDWNGD
RIQSGYSVIQPAVINLDMIKAS
Ligand information
Ligand IDPDO
InChIInChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2
InChIKeyYPFDHNVEDLHUCE-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(CO)CO
ACDLabs 11.02
CACTVS 3.352
OCCCO
FormulaC3 H8 O2
Name1,3-PROPANDIOL
ChEMBLCHEMBL379652
DrugBankDB02774
ZINCZINC000001529437
PDB chain1zv9 Chain A Residue 3001 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1zv9 Intermodular linker flexibility revealed from crystal structures of adjacent cellulosomal cohesins of Acetivibrio cellulolyticus.
Resolution1.28 Å
Binding residue
(original residue number in PDB)
N30 Q109 T110
Binding residue
(residue number reindexed from 1)
N29 Q108 T109
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
Biological Process
GO:0000272 polysaccharide catabolic process

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Molecular Function

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Biological Process
External links
PDB RCSB:1zv9, PDBe:1zv9, PDBj:1zv9
PDBsum1zv9
PubMed19501595
UniProtQ7WYN3

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