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Ligand · 630

630 · 1-{(3R,4R)-3-[({5-chloro-2-[(1-methyl-1H-pyrazol-4-yl)amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}oxy)methyl]-4-methoxypyrrolidin-1-yl}propan-1-one

630, 1-{(3R,4R)-3-[({5-chloro-2-[(1-methyl-1H-pyrazol-4-yl)amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}oxy)methyl]-4-methoxypyrrolidin-1-yl}propan-1-one (C19 H24 Cl N7 O3, 433.9 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record…

Component
630
Formula
C19 H24 Cl N7 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

630 in 1 structure; the first of them:

  • 5HG7 · EGFR (L858R, T790M, V948R) in complex with 1-{(3R,4R)-3-[5-Chloro-2-(1-methyl-1H-pyrazol-4… · 630 A9001 · binds LEU718, GLY719, SER720, PHE723, VAL726, ALA743, CYS775, MET790 and 10 more

Residues it binds most

LEU 1, CYS 1, GLY 1, MET 1, PHE 1, ALA 1, ARG 1, ASP 1, GLN 1, PRO 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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