Structure of PDB 6izj Chain A Binding Site BS01
Receptor Information
>6izj Chain A (length=138) Species:
158878
(Staphylococcus aureus subsp. aureus Mu50) [
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EAIIEDRRFQETLDKIRKEEGYDFAAIAFYESNKPSSPIKWHYVSGNKNN
RFKLIILRKGRGLAGTVMKTGKRMVIANVGLALGPEEKIDYPILLSESLT
AVLAVPLWYKNQVYGVLLFGQRDGRPLPKIFDNDDIQR
Ligand information
Ligand ID
NO3
InChI
InChI=1S/NO3/c2-1(3)4/q-1
InChIKey
NHNBFGGVMKEFGY-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
CACTVS 3.341
[O-][N+]([O-])=O
OpenEye OEToolkits 1.5.0
[N+](=O)([O-])[O-]
Formula
N O3
Name
NITRATE ION
ChEMBL
CHEMBL186200
DrugBank
DB14049
ZINC
PDB chain
6izj Chain A Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
6izj
Structural insights into the conformational change of Staphylococcus aureus NreA at C-terminus.
Resolution
2.1 Å
Binding residue
(original residue number in PDB)
W44 L60 G65 L66 Y94 P95 I96
Binding residue
(residue number reindexed from 1)
W41 L57 G62 L63 Y91 P92 I93
Annotation score
3
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:6izj
,
PDBe:6izj
,
PDBj:6izj
PDBsum
6izj
PubMed
31970556
UniProt
A0A0H3JU14
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