BBI · (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone

Binding sites

BBI in 6 structures; the first of them:

• 5H4D · Crystal structure of hSIRT3 in complex with a specific agonist Amiodarone hydrochloride · BBI A403 · binds PHE157, ARG158, GLU177, PHE294, GLU323, VAL324
• 8E57 · Rabbit L-type voltage-gated calcium channel Cav1.1 in the presence of Amiodarone and 100… · BBI A1902 · binds ILE925, VAL932, THR935, THR936, PHE1008, SER1011, THR1012, PHE1013 and 8 more
• 8E58 · Rabbit L-type voltage-gated calcium channel Cav1.1 in the presence of Amiodarone and 1 mM… · BBI A1902 · binds ILE925, VAL932, THR935, THR936, PHE1008, SER1011, THR1012, PHE1013 and 9 more
• 8E59 · Human L-type voltage-gated calcium channel Cav1.3 in the presence of Amiodarone at 3.1… · BBI A2201 · binds ILE1012, MET1019, THR1022, THR1023, PHE1095, SER1098, THR1099, PHE1100 and 9 more
• 8E5B · Human L-type voltage-gated calcium channel Cav1.3 in the presence of Amiodarone and… · BBI A2201 · binds ILE1012, MET1019, THR1022, THR1023, PHE1095, SER1098, THR1099, PHE1100 and 9 more
• 8FHS · Human L-type voltage-gated calcium channel Cav1.2 in the presence of amiodarone and… · BBI A2302 · binds ILE1046, ILE1049, VAL1053, THR1056, THR1057, PHE1129, SER1132, THR1133 and 10 more

Residues it binds most

PHE 7, THR 5, MET 5, ILE 5, ALA 5, VAL 5, LEU 5, SER 5, TYR 5, GLU 2 (residue and the binding sites it lines).

Found with

• CA · Calcium ion
• NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
• 3PE · 1,2-diacyl-sn-glycero-3-phosphoethanolamine
• WFR · propan-2-yl (2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-4-ethynyl-3-hydroxy-4-methyloxolan-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate (non-preferred name)
• WG6 · Sofosbuvir
• BMA · beta-D-mannopyranose
• CLR · Cholesterol
• MCM · 7-amino-4-methyl-chromen-2-one
• NAD · Nicotinamide-adenine-dinucleotide
• MG · Magnesium ion
• ZN · Zinc ion
• PEG · Di(hydroxyethyl)ether