5I8G
CBP in complex with Cpd637 ((R)-4-methyl-6-(1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-5-yl)-1,3,4,5-tetrahydro-2H-benzo[b][1,4]diazepin-2-one)
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | CREB-binding protein | polymer | 264 | 31219.4 | 1 | UniProt (Q92793) Pfam (PF00439) Pfam (PF06001) Pfam (PF23570) | Homo sapiens (Human) | |
| 2 | B, C, D (A) | ZINC ION | non-polymer | 65.4 | 3 | Chemie (ZN) | |||
| 3 | E (A) | (4R)-4-methyl-6-[1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-5-yl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one | non-polymer | 386.4 | 1 | Chemie (69E) PubChem (121271792) PubChem (127051477) PubChem (131698633) | |||
| 4 | F (A) | 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL | non-polymer | 282.3 | 1 | Chemie (B3P) PubChem (125132) | |||
| 5 | G, H, I, J, K (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 5 | Chemie (EDO) | |||
| 6 | L (A) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) PubChem (923) | |||
| 7 | M, N (A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 2 | Chemie (PEG) PubChem (8117) | |||
| 8 | O (A) | water | water | 18.0 | 213 | Chemie (HOH) |
Sequence modifications
A: 1081 - 1312 (UniProt: Q92793)
| PDB | External Database | Details |
|---|---|---|
| Met 1049 | - | initiating methionine |
| His 1050 | - | expression tag |
| His 1051 | - | expression tag |
| His 1052 | - | expression tag |
| His 1053 | - | expression tag |
| His 1054 | - | expression tag |
| His 1055 | - | expression tag |
| Gly 1056 | - | expression tag |
| Ser 1057 | - | expression tag |
| Leu 1058 | - | expression tag |
| Val 1059 | - | expression tag |
| Pro 1060 | - | expression tag |
| Arg 1061 | - | expression tag |
| Gly 1062 | - | expression tag |
| Ser 1063 | - | expression tag |
| Met 1064 | - | expression tag |
| Asp 1065 | - | expression tag |
| Tyr 1066 | - | expression tag |
| Lys 1067 | - | expression tag |
| Asp 1068 | - | expression tag |
| Asp 1069 | - | expression tag |
| Asp 1070 | - | expression tag |
| Asp 1071 | - | expression tag |
| Lys 1072 | - | expression tag |
| Glu 1073 | - | expression tag |
| Asn 1074 | - | expression tag |
| Leu 1075 | - | expression tag |
| Tyr 1076 | - | expression tag |
| Phe 1077 | - | expression tag |
| Gln 1078 | - | expression tag |
| Gly 1079 | - | expression tag |
| Ser 1080 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 31219.4 | |
| Non-Polymers* | Number of molecules | 13 |
| Total formula weight | 1410.6 | |
| All* | Total formula weight | 32630.0 |
