Structure of PDB 4owj Chain C Binding Site BS01
Receptor Information
>4owj Chain C (length=131) Species:
216895
(Vibrio vulnificus CMCP6) [
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MAHVTLQSLSNNDLCLDVYGENGDKTVAGGSVNGWSCHGSWNQVWGLDKE
ERYRSRVASDRCLTVNADKTLTVEQCGANLAQKWYWEGDKLISRYVDGNN
TRYLLNIVGGRNVQVTPENEANQARWKPTLQ
Ligand information
Ligand ID
GOL
InChI
InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKey
PEDCQBHIVMGVHV-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.0
C(C(CO)O)O
ACDLabs 12.01
CACTVS 3.370
OCC(O)CO
Formula
C3 H8 O3
Name
GLYCEROL;
GLYCERIN;
PROPANE-1,2,3-TRIOL
ChEMBL
CHEMBL692
DrugBank
DB09462
ZINC
ZINC000000895048
PDB chain
4owj Chain C Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
4owj
Glycan Specificity of the Vibrio vulnificus Hemolysin Lectin Outlines Evolutionary History of Membrane Targeting by a Toxin Family.
Resolution
2.0 Å
Binding residue
(original residue number in PDB)
D353 Y355 K361 W371 N378
Binding residue
(residue number reindexed from 1)
D17 Y19 K25 W35 N42
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:4owj
,
PDBe:4owj
,
PDBj:4owj
PDBsum
4owj
PubMed
24862282
UniProt
P19247
|VVHA_VIBVU Cytolysin (Gene Name=vvhA)
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