Structure of PDB 5kef Chain B Binding Site BS01
Receptor Information
>5kef Chain B (length=152) Species:
1193576
(Staphylococcus aureus subsp. aureus CN1) [
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MVFYMTALFPYIAFENSKEALAYYEEVFGATDVKRLEVGEEQASHFGMTK
EEAQEATMHAEFEVLGVKVLCSDSFGRADKINNGISLLIDYDVNNKEDAD
KVEAFYEQIKDHSSIEIELPFADQFWGGKMGVFTDKYGVRWMLHGQDYTA
IQ
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
5kef Chain B Residue 201 [
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Receptor-Ligand Complex Structure
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PDB
5kef
Crystal structure of Staphylococcus aureus Zn-glyoxalase I: new subfamily of glyoxalase I family.
Resolution
2.23 Å
Binding residue
(original residue number in PDB)
H58 E60
Binding residue
(residue number reindexed from 1)
H59 E61
Annotation score
4
External links
PDB
RCSB:5kef
,
PDBe:5kef
,
PDBj:5kef
PDBsum
5kef
PubMed
28034013
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