Structure of PDB 6i90 Chain A Binding Site BS02

Receptor Information

>6i90 Chain A (length=274) Species: 235909 (Geobacillus kaustophilus HTA426) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

TIDWEHPMFKLYEKAKRNGKWNPADIDFSQDQKDFASLTSEEKISALPLV
AGFSAFEEAVTLDILPMAHALARQGRLEDVLFLTTFMHDEAKHVEMFSRW
QQAVGIGQMDLSVFHNDHYKRIFYEALPEAMNRLYADDSPEAVIRAATVY
NMIVEGTLAESGYYTFRQIYKKAGLFPGLLQGIDYLNMDEGRHIQFGIYT
IQRIVNEDERYYELFIRYMDELWPHVIGYVDYLTELGKRQQQLARTYALE
IDYDLLRHYVIKQFNLRKKQISRT

Ligand information

Ligand ID

InChI

InChI=1S/Fe/q+3

InChIKey

VTLYFUHAOXGGBS-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04 CACTVS 3.341 OpenEye OEToolkits 1.5.0	[Fe+3]

Formula

Name

FE (III) ION

PDB chain

6i90 Chain A Residue 404 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	6i90 Chemical flexibility of heterobimetallic Mn/Fe cofactors: R2lox and R2c proteins.
Resolution	1.803 Å
Binding residue (original residue number in PDB)	E102 E167 E202 H205
Binding residue (residue number reindexed from 1)	E90 E155 E190 H193
Annotation score	1

Enzymatic activity

Enzyme Commision number

1.17.4.1: ribonucleoside-diphosphate reductase.

Gene Ontology

	Molecular Function
GO:0016491	oxidoreductase activity
GO:0046872	metal ion binding

	Biological Process
GO:0009263	deoxyribonucleotide biosynthetic process

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Molecular Function

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Biological Process

External links

PDB	RCSB:6i90, PDBe:6i90, PDBj:6i90
PDBsum	6i90
PubMed	31591267
UniProt	Q5KW80

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