6P7G
The co-crystal structure of BRAF(V600E) with PHI1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D (A, B, C, D) | Serine/threonine-protein kinase B-raf | polymer | 297 | 33752.7 | 4 | UniProt (P15056) Pfam (PF07714) | Homo sapiens (Human) | Proto-oncogene B-Raf,p94,v-Raf murine sarcoma viral oncogene homolog B1 |
| 2 | E, F, H, I (A, B, C, D) | 3-[(imidazo[1,2-b]pyridazin-3-yl)ethynyl]-4-methyl-N-[4-({[2-(morpholin-4-yl)ethyl]amino}methyl)-3-(trifluoromethyl)phenyl]benzamide | non-polymer | 562.6 | 4 | Chemie (E7M) | |||
| 3 | G (B) | 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID | non-polymer | 207.3 | 1 | Chemie (NHE) | |||
| 4 | J, K, L, M (A, B, C, D) | water | water | 18.0 | 50 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 448 - 723 (UniProt: P15056)
| PDB | External Database | Details |
|---|---|---|
| Met 427 | - | initiating methionine |
| Gly 428 | - | expression tag |
| Ser 429 | - | expression tag |
| Ser 430 | - | expression tag |
| His 431 | - | expression tag |
| His 432 | - | expression tag |
| His 433 | - | expression tag |
| His 434 | - | expression tag |
| His 435 | - | expression tag |
| His 436 | - | expression tag |
| Ser 437 | - | expression tag |
| Ser 438 | - | expression tag |
| Gly 439 | - | expression tag |
| Leu 440 | - | expression tag |
| Val 441 | - | expression tag |
| Pro 442 | - | expression tag |
| Arg 443 | - | expression tag |
| Gly 444 | - | expression tag |
| Ser 445 | - | expression tag |
| Lys 446 | - | expression tag |
| Met 447 | - | expression tag |
| Ala 543 | Ile 543 | engineered mutation |
| Ser 544 | Ile 544 | engineered mutation |
| Lys 551 | Ile 551 | engineered mutation |
| Arg 562 | Gln 562 | engineered mutation |
| Asn 588 | Leu 588 | engineered mutation |
| Glu 600 | Val 600 | engineered mutation |
| Ser 630 | Lys 630 | engineered mutation |
| Glu 667 | Phe 667 | engineered mutation |
| Ser 673 | Tyr 673 | engineered mutation |
| Arg 688 | Ala 688 | engineered mutation |
| Ser 706 | Leu 706 | engineered mutation |
| Arg 709 | Gln 709 | engineered mutation |
| Glu 713 | Ser 713 | engineered mutation |
| Glu 716 | Leu 716 | engineered mutation |
| Glu 720 | Ser 720 | engineered mutation |
| Ser 722 | Pro 722 | engineered mutation |
| Gly 723 | Lys 723 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 135010.7 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 2457.6 | |
| All* | Total formula weight | 137468.3 |
