Structure of PDB 4b9h Chain A Binding Site BS01

Receptor Information
>4b9h Chain A (length=189) Species: 5499 (Fulvia fulva) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CGSTSNIKYTVVKGDTLTSIAKKFKSGICNIVSVNKLANPNLIELGATLI
IPENCSNPDNKSCVSTPAEPTETCVPGLPGSYTIVSGDTLTNISQDFNIT
LDSLIAANTQIENPDAIDVGQIITVPVCPSSQCEAVGTYNIVAGDLFVDL
AATYHTTIGQIKALNNNVNPSKLKVGQQIILPQDCKNVT
Ligand information
Ligand IDI3C
InChIInChI=1S/C8H4I3NO4/c9-3-1(7(13)14)4(10)6(12)5(11)2(3)8(15)16/h12H2,(H,13,14)(H,15,16)
InChIKeyJEZJSNULLBSYHV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1(c(c(c(c(c1I)N)I)C(=O)O)I)C(=O)O
CACTVS 3.341Nc1c(I)c(C(O)=O)c(I)c(C(O)=O)c1I
ACDLabs 10.04Ic1c(C(=O)O)c(I)c(c(I)c1N)C(=O)O
FormulaC8 H4 I3 N O4
Name5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid;
5-Amino-2,4,6-triiodoisophthalic acid
ChEMBL
DrugBank
ZINCZINC000004806327
PDB chain4b9h Chain A Residue 1203 [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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PDB4b9h Fungal Effector Ecp6 Outcompetes Host Immune Receptor for Chitin Binding Through Intrachain Lysm Dimerization
Resolution2.1 Å
Binding residue
(original residue number in PDB)		H161 D190 K192
Binding residue
(residue number reindexed from 1)		H155 D184 K186
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:4b9h, PDBe:4b9h, PDBj:4b9h
PDBsum4b9h
PubMed23840930
UniProtB3VBK9|LYSM_PASFU Secreted LysM effector ECP6 (Gene Name=ECP6)

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