Structure of PDB 8a8o Chain C Binding Site BS02

Receptor Information
>8a8o Chain C (length=101) Species: 523845 (Methanothermococcus thermolithotrophicus DSM 2095) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TIRIIEEICIGCGLCTKVCPGNLLYQREDGKSEIMDKRDCWDCAACVKEC
PVNAIEMYLQPEIGGRGSTLKAKKTDDSIVWIITDNNGEEEVIEVKNKKT
F
Ligand information
Ligand IDSF4
InChIInChI=1S/4Fe.4S
InChIKeyLJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
FormulaFe4 S4
NameIRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain8a8o Chain C Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8a8o How a methanogen assimilates sulfate: Structural and functional elucidation of the complete sulfate-reduction pathway.
Resolution1.45 Å
Binding residue
(original residue number in PDB)		C10 I11 G12 C13 G14 C16 S33 C51 P52 A55 I56
Binding residue
(residue number reindexed from 1)		C9 I10 G11 C12 G13 C15 S32 C50 P51 A54 I55
Annotation score4
External links