Structure of PDB 5zn8 Chain B Binding Site BS01
Receptor Information
>5zn8 Chain B (length=181) Species:
1423
(Bacillus subtilis) [
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MKKALICIDYTNDFAAENGALTCGEPARQIEDTIVSLTQAFIENGDYVVF
AVDSHDDDFHPETRLFPPHNINGTEGKELYGRLSPLYEKHKHAKNVNYME
KTRYSAFAGTDLELKLRERQITELHLAGLCTDICVLHTAVDAYNKGFQIV
IHQNAVASFNPEGHEWALSHFKNSIGAQVAE
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
5zn8 Chain B Residue 201 [
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Receptor-Ligand Complex Structure
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PDB
5zn8
Crystal structure of the nicotinamidase/pyrazinamidase PncA from Bacillus subtilis.
Resolution
2.0 Å
Binding residue
(original residue number in PDB)
D53 H55 E64 H71
Binding residue
(residue number reindexed from 1)
D53 H55 E62 H69
Annotation score
4
External links
PDB
RCSB:5zn8
,
PDBe:5zn8
,
PDBj:5zn8
PDBsum
5zn8
PubMed
30107912
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