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Ligand · RJK

RJK · 1-[4-[4-(aminomethyl)pyrazol-1-yl]-3-chloranyl-phenyl]-3-[(3~{R})-6-bromanyl-3,4-dihydro-2~{H}-chromen-3-yl]urea

RJK, 1-[4-[4-(aminomethyl)pyrazol-1-yl]-3-chloranyl-phenyl]-3-[(3~{R})-6-bromanyl-3,4-dihydro-2~{H}-chromen-3-yl]urea (C20 H19 Br Cl N5 O2, 476.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
RJK
Formula
C20 H19 Br Cl N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

RJK in 2 structures; the first of them:

  • 7AK0 · Human MALT1(329-729) in complex with a chromane urea containing inhibitor · RJK A801 · binds VAL344, ALA345, LEU346, LYS379, VAL381, LEU383, LEU386, TYR389 and 15 more
  • 7AK0 · Human MALT1(329-729) in complex with a chromane urea containing inhibitor · RJK A801 · binds ALA345, LEU346, LYS379, VAL381, LEU383, GLU390, ASN393, ALA394 and 11 more

Residues it binds most

LEU 4, ALA 4, GLN 4, GLU 4, LYS 4, VAL 4, ARG 4, ASN 4, ILE 4, MET 4 (residue and the binding sites it lines).

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