Structure of PDB 5zn8 Chain A Binding Site BS01

Receptor Information
>5zn8 Chain A (length=182) Species: 1423 (Bacillus subtilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKKALICIDYTNDFAAENGALTCGEPARQIEDTIVSLTQAFIENGDYVVF
AVDSHADDDFHPETRLFPPHNINGTEGKELYGRLSPLYEKHKHAKNVNYM
EKTRYSAFAGTDLELKLRERQITELHLAGLCTDICVLHTAVDAYNKGFQI
VIHQNAVASFNPEGHEWALSHFKNSIGAQVAE
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5zn8 Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5zn8 Crystal structure of the nicotinamidase/pyrazinamidase PncA from Bacillus subtilis.
Resolution2.0 Å
Binding residue
(original residue number in PDB)
D53 H55 E64 H71
Binding residue
(residue number reindexed from 1)
D53 H55 E63 H70
Annotation score4
External links