A1AHE · N-[3-fluoro-4-({7-[(3-fluoropyridin-2-yl)oxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}methyl)pyridin-2-yl]-N'-methylsulfuric diamide

Binding sites

A1AHE in 7 structures; the first of them:

• 9AXA · CryoEM structure of activated CRAF/MEK/14-3-3 complex with NST-628 · A1AHE B401 · binds ASN552, ASN553, ARG554, LEU118, VAL127, GLY128, PHE129, ILE141 and 14 more
• 9AXH · Crystal structure of KSR1/MEK1 complex heterotetramer with NST-628 · A1AHE A401 · binds LYS97, LEU115, LEU118, ILE126, VAL127, GLY128, PHE129, ILE141 and 17 more
• 9AXM · Crystal structure of ARAF/MEK1 complex with NST-628 and a RAF dimer · A1AHE A401 · binds LYS97, LEU115, LEU118, VAL127, GLY128, PHE129, ILE141, CYS142 and 19 more
• 9AXX · Crystal structure of BRAF/MEK1 complex with NST-628 and an active RAF dimer · A1AHE A401 · binds LYS97, LEU115, LEU118, VAL127, GLY128, PHE129, ILE141, CYS142 and 19 more
• 9AXY · Crystal structure of BRAF/MEK complex with NST-628 and inactive RAF · A1AHE B401 · binds ASN660, ASN661, ARG662, ASP663, LYS97, LEU115, LEU118, ILE126 and 21 more
• 9AY7 · Crystal structure of CRAF/MEK1 complex with NST-628 and inactive RAF · A1AHE B401 · binds ASN552, ASN553, ARG554, LYS97, LEU115, LEU118, VAL127, GLY128 and 18 more
• 9AYA · Crystal structure of CRAF/MEK complex with NST-628 and active RAF dimer · A1AHE B401 · binds ASN552, ASN553, ARG554, LYS97, LEU115, LEU118, ILE126, VAL127 and 19 more

Residues it binds most

LEU 12, ARG 12, MET 12, ILE 12, ASP 12, GLY 12, PHE 12, VAL 12, CYS 12, ASN 8 (residue and the binding sites it lines).

Found with

• ANP · Phosphoaminophosphonic acid-adenylate ester
• MG · Magnesium ion
• EDO · 1,2-ethanediol
• NI · Nickel (II) ion
• CL · Chloride ion
• ACT · Acetate ion
• GOL · Glycerol
• TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol