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Ligand · 1SW

1SW · N-{7-cyano-6-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide

1SW, N-{7-cyano-6-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide (C26 H17 F4 N5 O3 S, 555.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
1SW
Formula
C26 H17 F4 N5 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

1SW in 2 structures; the first of them:

  • 4KSQ · Crystal Structure of Human B-raf bound to a DFG-out Inhibitor 5B · 1SW A901 · binds ILE462, VAL470, ALA480, LYS482, GLU500, VAL503, LEU504, ILE512 and 15 more
  • 4KSQ · Crystal structure of human B-RAF bound to a dfg-out inhibitor 5B · 1SW A901 · binds ILE462, VAL470, ALA480, LYS482, GLU500, VAL503, LEU504, ILE512 and 15 more

Residues it binds most

ILE 4, LEU 4, GLU 4, GLY 4, PHE 4, VAL 4, THR 4, ALA 4, ASP 4, CYS 4 (residue and the binding sites it lines).

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