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Ligand · 96L

96L · (1R,9S,12R)-13-[[8-[[1-(2-fluoranyl-2-methyl-propyl) piperidin-4-yl]amino]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]carbonyl]-12-propan-2-yl-11,13-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4,6-trien-10-one

96L, (1R,9S,12R)-13-[[8-[[1-(2-fluoranyl-2-methyl-propyl) piperidin-4-yl]amino]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]carbonyl]-12-propan-2-yl-11,13-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4,6-trien-10-one (C30 H39 F N8 O2, 562.7…

Component
96L
Formula
C30 H39 F N8 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

96L in 2 structures; the first of them:

  • 7Q6T · Crystal structure of the bromodomain of ATAD2 with AZ13824374 · 96L A1203 · binds ARG1007, VAL1008, PHE1009, THR1010, LYS1011, PRO1012, VAL1013, ASP1014 and 10 more
  • 7Q6T · Crystal structure of the bromodomain of ATAD2 with AZ13824374 · 96L A1203 · binds ARG1007, VAL1008, PHE1009, THR1010, LYS1011, VAL1013, ASP1014, GLU1017 and 7 more

Residues it binds most

ASP 2, VAL 2, TYR 2, ARG 2, ASN 2, GLU 2, GLY 2, ILE 2, LYS 2, PHE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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