6Z45
CDK9-Cyclin-T1 complex bound by compound 24
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Cyclin-dependent kinase 9 | polymer | 330 | 38043.0 | 1 | UniProt (P50750) Pfam (PF00069) | Homo sapiens (Human) | C-2K,Cell division cycle 2-like protein kinase 4,Cell division protein kinase 9,Serine/threonine-protein kinase PITALRE,Tat-associated kinase complex catalytic subunit |
| 2 | B (B) | Cyclin-T1 | polymer | 258 | 29907.2 | 1 | UniProt (O60563) Pfam (PF00134) Pfam (PF21797) | Homo sapiens (Human) | Cyclin-T |
| 3 | C (A) | (1~{S},3~{R})-3-acetamido-~{N}-[5-chloranyl-4-(5,5-dimethyl-4,6-dihydropyrrolo[1,2-b]pyrazol-3-yl)pyridin-2-yl]cyclohexane-1-carboxamide | non-polymer | 429.9 | 1 | Chemie (Q6E) | |||
| 4 | D (B) | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL | non-polymer | 122.1 | 1 | Chemie (TRS) | |||
| 5 | E (B) | PHOSPHATE ION | non-polymer | 95.0 | 1 | Chemie (PO4) |
Sequence modifications
A: 1 - 330 (UniProt: P50750)
B: 2 - 259 (UniProt: O60563)
| PDB | External Database | Details |
|---|---|---|
| Asp 7 | Ser 7 | conflict |
| Asn 8 | Val 8 | conflict |
| Arg 44 | Lys 44 | conflict |
| Phe 138 | Tyr 138 | conflict |
| Asn 181 | Gln 181 | conflict |
| Ala 280 | Lys 280 | conflict |
| Glu 307 | Asp 307 | conflict |
| Glu 311 | Asn 311 | conflict |
| PDB | External Database | Details |
|---|---|---|
| Ala 26 | Arg 26 | conflict |
| Arg 77 | Gln 77 | conflict |
| Gly 96 | Glu 96 | conflict |
| Arg 106 | Lys 106 | conflict |
| Leu 241 | Phe 241 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 67950.2 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 647.1 | |
| All* | Total formula weight | 68597.2 |
