Structure of PDB 8jc1 Chain C Binding Site BS01

Receptor Information
>8jc1 Chain C (length=267) Species: 554 (Pectobacterium carotovorum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ATYKIKDLTGNVEFECSDDTYILDAAEEAGLDLPYSCRAGSCSSCVALLI
SGSVDQRDASFLDEEQQKYFVLTCAAYPNSNCVIKTGVEEMLLGYDSYRD
MSEYLFGLLGGNDSPELLDGLFTPVDAFRHYLFGNGTNKSININDVGLSI
DVSQIPPIMNIINQGFIGRFDISSDFNRNTVLDGIIPASYLGNITLKTEG
VLSISPDGAWSYNGGIRAYNDLYDANPSTHRDRLGEWSTGVLDKFNGTPY
EIQIPGTLDISGRGQRL
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0
S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain8jc1 Chain C Residue 302 [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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PDB8jc1 Crystal structure of pectocin M1 reveals diverse conformations and interactions during its initial step via the ferredoxin uptake system.
Resolution2.04 Å
Binding residue
(original residue number in PDB)
Y36 C38 G41 C43 C46 L73 C75
Binding residue
(residue number reindexed from 1)
Y35 C37 G40 C42 C45 L72 C74
Annotation score4
External links