79C · 4-[(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-yl) amino]-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide

Binding sites

79C in 8 structures; the first of them:

• 7L72 · Crystal structure of the second bromodomain (BD2) of human BRD3 bound to Ro3280 · 79C A501 · binds TRP332, PRO333, PHE334, VAL338, LEU343, LEU345, TYR348, CYS387 and 4 more
• 7LAJ · Crystal structure of the first bromodomain (BD1) of human BRD2 bound to Ro3280 · 79C A201 · binds TRP97, PRO98, PHE99, VAL103, LEU108, LEU110, TYR113, TYR155 and 1 more
• 5TA8 · Crystal structure of PLK1 in complex with a novel 5,6- DIHYDROIMIDAZOLO[1,5-F]PTERIDINE… · 79C A402 · binds PHE58, LEU59, GLY60, CYS67, GLU69, ALA80, LYS82, VAL114 and 7 more
• 5VBP · Crystal structure of the first bromodomain of human BRD4 in complex with RO3280 · 79C A204 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, TYR139 and 5 more
• 7BJY · Crystal structure of the first bromodomain (BD1) of human brdt bound to RO3280 · 79C A201 · binds TRP50, PRO51, PHE52, VAL56, LEU61, LEU63, TYR66, CYS105 and 3 more
• 7L72 · Crystal structure of the second bromodomain (BD2) of human BRD3 bound to RO3280 · 79C A501 · binds TRP332, PRO333, PHE334, VAL338, LEU343, LEU345, TYR348, CYS387 and 4 more
• 7L9J · Crystal structure of the second bromodomain (BD2) of human BRD2 bound to RO3280 · 79C A501 · binds TRP370, PRO371, PHE372, VAL376, LEU381, LEU383, TYR386, TYR428 and 3 more
• 7LAJ · Crystal structure of the first bromodomain (BD1) of human BRD2 bound to RO3280 · 79C A201 · binds TRP97, PRO98, PHE99, VAL103, LEU108, LEU110, TYR113, TYR155 and 1 more

Residues it binds most

LEU 10, TYR 9, VAL 10, PHE 10, TRP 9, ASN 9, PRO 9, ILE 4, CYS 4, HIS 3 (residue and the binding sites it lines).

Found with

• EDO · 1,2-ethanediol
• ZN · Zinc ion
• CL · Chloride ion
• DMS · Dimethyl sulfoxide
• PEG · Di(hydroxyethyl)ether