Structure of PDB 4hgw Chain A Binding Site BS02
Receptor Information
>4hgw Chain A (length=217) Species:
10090
(Mus musculus) [
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DIVMSQSPSSLAVSAGEKVTMSCKSSQSLLNSRTRKNYLAWYQQKPGQSP
KLLIYWASTRESGVPDRFTGSGSGTDFTLTITSVQAEDLAVYYCKQSYNL
RTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDIN
VKWKIDGSERGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEAT
HKTSTSPIVKSFNRNEC
Ligand information
Ligand ID
ZN
InChI
InChI=1S/Zn/q+2
InChIKey
PTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
Formula
Zn
Name
ZINC ION
ChEMBL
CHEMBL1236970
DrugBank
DB14532
ZINC
PDB chain
4hgw Chain A Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
4hgw
Exploring the cross-reactivity of S25-2: complex with a 5,6-dehydro-Kdo disaccharide.
Resolution
1.65 Å
Binding residue
(original residue number in PDB)
E184 H188
Binding residue
(residue number reindexed from 1)
E188 H192
Annotation score
4
External links
PDB
RCSB:4hgw
,
PDBe:4hgw
,
PDBj:4hgw
PDBsum
4hgw
PubMed
23295476
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