Structure of PDB 5flh Chain A Binding Site BS01
Receptor Information
>5flh Chain A (length=190) Species:
375060
(Streptomyces sp. FLA) [
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IEYATRHRARSFIPPEPGKPYFIEKGLGDRAHLFGDLITIYAGGEQTENT
FNFFTCEGPKGEVIPAHSHADTYEVFYITQGAVRLFVEDLEGEQHEKLLT
PGDFGFVPKNCVHAYRMERHHSQVVGVAAGPGGTFERFFESLGTPAEELG
LPVRPFVPEPEKFRTVPEQYDVRFRPDHQWHTGSIEGRKL
Ligand information
Ligand ID
NI
InChI
InChI=1S/Ni/q+2
InChIKey
VEQPNABPJHWNSG-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Ni++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ni+2]
Formula
Ni
Name
NICKEL (II) ION
ChEMBL
DrugBank
DB14204
ZINC
PDB chain
5flh Chain A Residue 500 [
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Receptor-Ligand Complex Structure
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PDB
5flh
Quercetin 2,4-Dioxygenase Activates Dioxygen in a Side-on O2 -Ni Complex.
Resolution
1.802 Å
Binding residue
(original residue number in PDB)
H69 H71 E76 H115
Binding residue
(residue number reindexed from 1)
H67 H69 E74 H113
Annotation score
4
Enzymatic activity
Catalytic site (original residue number in PDB)
H69 H71 E76 H115
Catalytic site (residue number reindexed from 1)
H67 H69 E74 H113
Enzyme Commision number
?
External links
PDB
RCSB:5flh
,
PDBe:5flh
,
PDBj:5flh
PDBsum
5flh
PubMed
26846734
UniProt
A2VA43
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