5KJ2
The novel p300/CBP inhibitor A-485 uncovers a unique mechanism of action to target AR in castrate resistant prostate cancer
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Histone acetyltransferase p300 | polymer | 348 | 40261.0 | 1 | UniProt (Q09472) Pfam (PF08214) In PDB | Homo sapiens (Human) | p300 HAT,E1A-associated protein p300 |
2 | A | N-[(4-fluorophenyl)methyl]-2-{(1R)-5-[(methylcarbamoyl)amino]-2',4'-dioxo-2,3-dihydro-3'H-spiro[indene-1,5'-[1,3]oxazolidin]-3'-yl}-N-[(2S)-1,1,1-trifluoropropan-2-yl]acetamide | non-polymer | 536.5 | 1 | Chemie (6TF) | |||
3 | A | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
4 | water | water | 18.0 | 259 | Chemie (HOH) |
Sequence modifications
A: 1287 - 1666 (UniProt: Q09472)
PDB | External Database | Details |
---|---|---|
- | Glu 1523 | deletion |
- | Glu 1524 | deletion |
- | Glu 1525 | deletion |
- | Glu 1526 | deletion |
- | Arg 1527 | deletion |
- | Lys 1528 | deletion |
- | Arg 1529 | deletion |
- | Glu 1530 | deletion |
- | Glu 1531 | deletion |
- | Asn 1532 | deletion |
- | Thr 1533 | deletion |
- | Ser 1534 | deletion |
- | Asn 1535 | deletion |
- | Glu 1536 | deletion |
- | Ser 1537 | deletion |
- | Thr 1538 | deletion |
- | Asp 1539 | deletion |
- | Val 1540 | deletion |
- | Thr 1541 | deletion |
- | Lys 1542 | deletion |
- | Gly 1543 | deletion |
- | Asp 1544 | deletion |
- | Ser 1545 | deletion |
- | Lys 1546 | deletion |
- | Asn 1547 | deletion |
- | Ala 1548 | deletion |
- | Lys 1549 | deletion |
- | Lys 1550 | deletion |
- | Lys 1551 | deletion |
- | Asn 1552 | deletion |
- | Asn 1553 | deletion |
- | Lys 1554 | deletion |
Arg 1637 | Lys 1637 | engineered mutation |
Gly 1652 | Met 1652 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 40261.0 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 559.5 | |
All* | Total formula weight | 40820.5 |