Structure of PDB 5t61 Chain F Binding Site BS08

Receptor Information
>5t61 Chain F (length=345) Species: 145261 (Methanothermobacter wolfeii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TTEVIEGKNITVERTGNRRLIFQDCLCAVCGLCGEICPVSAIEVNPTGAM
VRTEQEKSKIAIDENKCVLCGMCSSICPFQALDLQIDGTSIKELAEYPKI
IKSAEIDDETCIQCKACETACPQDAITITRELPERKDLVTGEIEIDKDTC
IYCGMCEEMCPVDAIEIDHQTPSSASPVVATDIRVDEDKCVHCGICKRIC
PVDAIMQVCRICPYGEYEIKTPEVTGTSYIDPELCVNCGWCQEICPVDAA
TVTKPFEGELIIDQDTCQACETCVMVCPCNVLSFPKPEKPGEKTTKLHKD
ERFCIYCGACERSCPVTAITVKRNRINTTPIRSKAWKNAFDSLLK
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 F Residue 408 [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 C157 G158 C160 I187 C204 P205 V206 I209
Binding residue
(residue number reindexed from 1)		C150 I151 C153 G154 C156 I183 C200 P201 V202 I205
Annotation score4
External links