22MJ
Crystal structure of human INPP5K with an allosteric inhibitor reveals the structural basis for species specific potency
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Inositol polyphosphate 5-phosphatase K | polymer | 322 | 37064.5 | 1 | UniProt (Q9BT40) | Homo sapiens (human) | Phosphatidylinositol-3,4,5-trisphosphate 5-phosphatase,Phosphatidylinositol-4,5-bisphosphate 5-phosphatase,Skeletal muscle and kidney-enriched inositol phosphatase |
| 2 | B, C, D, E, I (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 5 | Chemie (EDO) | |||
| 3 | F, G (A) | MALONATE ION | non-polymer | 102.0 | 2 | Chemie (MLI) | |||
| 4 | H (A) | 2-benzamido-4-phenyl-5-propan-2-yl-thiophene-3-carboxylic acid | non-polymer | 365.4 | 1 | Chemie (A1MDP) | |||
| 5 | J (A) | water | water | 18.0 | 92 | Chemie (HOH) |
Sequence modifications
A: 1 - 322 (UniProt: Q9BT40)
| PDB | External Database | Details |
|---|---|---|
| Ala 280 | Cys 280 | conflict |
| Lys 281 | - | insertion |
| Asn 283 | Gly 282 | conflict |
| - | Asp 284 | deletion |
| - | Thr 285 | deletion |
| - | Pro 286 | deletion |
| - | Ile 287 | deletion |
| - | Pro 288 | deletion |
| - | Pro 289 | deletion |
| - | Ala 290 | deletion |
| Gly 286 | His 292 | conflict |
| Leu 288 | Ser 294 | conflict |
| Thr 290 | Ser 296 | conflict |
| Gln 291 | Leu 297 | conflict |
| Lys 292 | Arg 298 | conflict |
| Asp 293 | Gly 299 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 37064.5 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 879.9 | |
| All* | Total formula weight | 37944.4 |
