Structure of PDB 6lfx Chain A Binding Site BS01

Receptor Information
>6lfx Chain A (length=239) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MDIQMTQTASSLSASLGDRVTISCRASQYINNYLNWYQQKPDGTVTLLIY
YTSILHSGVPSRFIGSGSGTDYSLTISNLDQEDIATYFCQQGYTLPLTFG
AGTKLELKRPGGGGSEVKLVESGGGLVKPGGSLKLSCAASGFTFSTYGMS
WVRQTPEKRLEWVASISGGGDTYYTDIVKGRVTISRDNDRNILYLQMSSL
RSEDTAMYHCTRGALVRLPHYYSMDYWGQGTSVTVSSLV
Ligand information
Ligand IDOM4
InChIInChI=1S/C13H9Cl3O/c1-17-13-5-3-9(7-12(13)16)8-2-4-10(14)11(15)6-8/h2-7H,1H3
InChIKeyHEPYVKVRVSITAU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385COc1ccc(cc1Cl)c2ccc(Cl)c(Cl)c2
OpenEye OEToolkits 2.0.6COc1ccc(cc1Cl)c2ccc(c(c2)Cl)Cl
FormulaC13 H9 Cl3 O
Name1,2-bis(chloranyl)-4-(3-chloranyl-4-methoxy-phenyl)benzene
ChEMBL
DrugBank
ZINC
PDB chain6lfx 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]
PDB6lfx Crystal structure of PCB4scFv(hN56D) in complex with PCB#77
Resolution1.43 Å
Binding residue
(original residue number in PDB)		Y93 T94 L95 G160 S177 I178 S179 Y185 H232 Y234
Binding residue
(residue number reindexed from 1)		Y93 T94 L95 G148 S165 I166 S167 Y173 H220 Y222
Annotation score1
External links