5AQW
Fragment-based screening of HSP70 sheds light on the functional role of ATP-binding site residues
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | HEAT SHOCK 70 KDA PROTEIN 1A | polymer | 394 | 43195.9 | 1 | UniProt (P0DMV8) Pfam (PF00012) In PDB | HOMO SAPIENS (HUMAN) | |
2 | A | (1S,2R,3R,5R)-3-(hydroxymethyl)-5-(quinazolin-4-ylamino)cyclopentane-1,2-diol | non-polymer | 275.3 | 1 | Chemie (5P7) | |||
3 | A | PHOSPHATE ION | non-polymer | 95.0 | 1 | Chemie (PO4) | |||
4 | A | (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL | non-polymer | 154.3 | 1 | Chemie (DTV) | |||
5 | A | 1,2-ETHANEDIOL | non-polymer | 62.1 | 12 | Chemie (EDO) | |||
6 | A | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
7 | water | water | 18.0 | 423 | Chemie (HOH) |
Sequence modifications
A: 1 - 380 (UniProt: P0DMV8)
PDB | External Database | Details |
---|---|---|
Gly -4 | - | expression tag |
Pro -3 | - | expression tag |
Leu -2 | - | expression tag |
Gly -1 | - | expression tag |
Ser 0 | - | expression tag |
Ile 381 | - | expression tag |
Lys 382 | - | expression tag |
Ser 383 | - | expression tag |
Thr 384 | - | expression tag |
Arg 385 | - | expression tag |
Ala 386 | - | expression tag |
Ala 387 | - | expression tag |
Ala 388 | - | expression tag |
Ser 389 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 43195.9 | |
Non-Polymers* | Number of molecules | 16 |
Total formula weight | 1293.6 | |
All* | Total formula weight | 44489.5 |