Structure of PDB 6lfw Chain A Binding Site BS01

Receptor Information
>6lfw Chain A (length=231) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MDIQMTQTASSLSASLGDRVTISCRASQYINNYLNWYQQKPDGTVTLLIY
YTSILHSGVPSRFIGSGSGTDYSLTISNLDQEDIATYFCQQGYTLPLTFG
AGTKLELKREVKLVESGGGLVKPGGSLKLSCAASGFTFSTYGMSWVRQTP
EKRLEWVASISGGGDTYYTDIVKGRVTISRDNDRNILYLQMSSLRSEDTA
MYHCTRGALVRLPHYYSMDYWGQGTSVTVSS
Ligand information
Ligand IDOMF
InChIInChI=1S/C13H8Cl4O/c1-18-12-3-2-7(4-9(12)14)8-5-10(15)13(17)11(16)6-8/h2-6H,1H3
InChIKeyZPWFINDBNFLFDF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385COc1ccc(cc1Cl)c2cc(Cl)c(Cl)c(Cl)c2
OpenEye OEToolkits 2.0.6COc1ccc(cc1Cl)c2cc(c(c(c2)Cl)Cl)Cl
FormulaC13 H8 Cl4 O
Name1,2,3-tris(chloranyl)-5-(3-chloranyl-4-methoxy-phenyl)benzene
ChEMBL
DrugBank
ZINC
PDB chain6lfw Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB6lfw Crystal structure of PCB4scFv(hN56D) in complex with PCB#126
Resolution1.41 Å
Binding residue
(original residue number in PDB)		Y93 T94 L95 G160 S162 S177 I178 S179 Y185 H232 Y234
Binding residue
(residue number reindexed from 1)		Y93 T94 L95 G142 S144 S159 I160 S161 Y167 H214 Y216
Annotation score1
External links