9JF6
Crystal Structure of human Pin1 in complex with a covalent inhibitor
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) | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | polymer | 158 | 17693.6 | 1 | UniProt (Q13526) | Homo sapiens (human) | Peptidyl-prolyl cis-trans isomerase Pin1,PPIase Pin1,Rotamase Pin1 |
| 2 | B (A) | methyl (~{Z})-4-[1-benzothiophen-2-ylmethyl-[(3~{S})-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-4-oxidanylidene-but-2-enoate | non-polymer | 393.5 | 1 | Chemie (A1EBR) | |||
| 3 | C (A) | 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | non-polymer | 252.3 | 1 | Chemie (1PG) |
Sequence modifications
A: 6 - 163 (UniProt: Q13526)
| PDB | External Database | Details |
|---|---|---|
| Gln 77 | Lys 77 | conflict |
| Gln 82 | Lys 82 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 17693.6 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 645.8 | |
| All* | Total formula weight | 18339.4 |
