Structure of PDB 5t61 Chain v Binding Site BS02

Receptor Information
>5t61 Chain v (length=346) Species: 145261 (Methanothermobacter wolfeii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ETTEVIEGKNITVERTENRRLIFQDCLCAVCGLCGEICPVSAIEVNPTGA
MVRTEQEKSKIAIDENKCVLCGMCSSICPFQALDLQIDGTSIKELAEYPK
IIKSAEIDDETCIQCKACETACPQDAITITRELPERKDLVTGEIEIDKDT
CIYCGMCEEMCPVDAIEIDHQTPSSASPVVATDIRVDEDKCVHCGICKRI
CPVDAIMQVCRICPYGEYEIKTPEVTGTSYIDPELCVNCGWCQEICPVDA
ATVTKPFEGELIIDQDTCQACETCVMVCPCNVLSFPKPEKPGEKTTKLHK
DERFCIYCGACERSCPVTAITVKRNRINTTPIRSKAWKNAFDSLLK
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 v Residue 501 [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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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)		C154 I155 Y156 C157 G158 C160 I187 C204 I209
Binding residue
(residue number reindexed from 1)		C151 I152 Y153 C154 G155 C157 I184 C201 I206
Annotation score4
External links