Structure of PDB 5t61 Chain p Binding Site BS05

Receptor Information
>5t61 Chain p (length=348) Species: 145261 (Methanothermobacter wolfeii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ETTEVIEGKNITVERTGEENRRLIFQDCLCAVCGLCGEICPVSAIEVNPT
GAMVRTEQEKSKIAIDENKCVLCGMCSSICPFQALDLQIDGTSIKELAEY
PKIIKSAEIDDETCIQCKACETACPQDAITITRELPERKDLVTGEIEIDK
DTCIYCGMCEEMCPVDAIEIDHQTPSSASPVVATDIRVDEDKCVHCGICK
RICPVDAIMQVCRICPYGEYEIKTPEVTGTSYIDPELCVNCGWCQEICPV
DAATVTKPFEGELIIDQDTCQACETCVMVCPCNVLSFPKPEKPGEKTTKL
HKDERFCIYCGACERSCPVTAITVKRNRINTTPIRSKAWKNAFDSLLK
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 chain5t61 Chain p Residue 405 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB5t61 The methanogenic CO2 reducing-and-fixing enzyme is bifunctional and contains 46 [4Fe-4S] clusters.
Resolution2.55 Å
Binding residue
(original residue number in PDB)		C125 I130 C239 V240 N241 C242 G243 C245
Binding residue
(residue number reindexed from 1)		C124 I129 C238 V239 N240 C241 G242 C244
Annotation score4
External links