6AOL
Structure of molecular chaperone Grp94 bound to selective inhibitor methyl 3-chloro-2-(2-{2-[(4-fluorophenyl)methyl]phenyl}ethyl)-4,6-dihydroxybenzoate
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Endoplasmin | polymer | 233 | 26187.6 | 1 | UniProt (P41148) Pfam (PF13589) In PDB | Canis lupus familiaris (Dog) | 94 kDa glucose-regulated protein, GRP-94, Heat shock protein 90 kDa beta member 1 |
2 | A | methyl 3-chloro-2-(2-{2-[(4-fluorophenyl)methyl]phenyl}ethyl)-4,6-dihydroxybenzoate | non-polymer | 414.9 | 1 | Chemie (VC1) | |||
3 | A | 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL | non-polymer | 326.4 | 4 | Chemie (P33) | |||
4 | water | water | 18.0 | 7 | Chemie (HOH) |
Sequence modifications
A: 69 - 286 (UniProt: P41148)
A: 328 - 337 (UniProt: P41148)
PDB | External Database | Details |
---|---|---|
Ser 68 | - | expression tag |
PDB | External Database | Details |
---|---|---|
Gly 324 | - | linker |
Gly 325 | - | linker |
Gly 326 | - | linker |
Gly 327 | - | linker |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 26187.6 | |
Non-Polymers* | Number of molecules | 5 |
Total formula weight | 1720.4 | |
All* | Total formula weight | 27908.0 |