Structure of PDB 8wen Chain C Binding Site BS01

Receptor Information
>8wen Chain C (length=336) Species: 817 (Bacteroides fragilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VTASIDLQSVSYTDLATQLNDVSDFGKMIILKDNGFNRQVHVSMDKRTKI
QLDNENVRLFNGRDKDSTSFILGDEFAVLRFYRNGESISYIAYKEAQMMN
EIAEFYAAPFKNEKEAFECIYDKDLVSVKINIDKAKKILNLPECDYIIKT
AVPSEPKTVYVICLRESGSTVYPNEVSAQMQDAANSVYAVHGLKRFVNLH
FVLYTTEYSCPSGNADEGLDGFTASLKANPKAEGYDDQIYFLIRWGTWDN
NILGISWLDSYNVNTASDFKASGMSTTQLMYPGVMAHELGHILGARHADD
PKDLMYSKYTGYLFHLSEENMYRIAKNLGWEIADGD
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain8wen Chain C Residue 401 [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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PDB8wen Bacteroides fragilis toxin 2
Resolution1.97 Å
Binding residue
(original residue number in PDB)		H348 H352 H358
Binding residue
(residue number reindexed from 1)		H287 H291 H297
Annotation score4
External links