9JJS
Crystal Structure of human Pin1 catalytic domain 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, B (A, B) | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | polymer | 121 | 13402.9 | 2 | UniProt (Q13526) Pfam (PF00639) | Homo sapiens (human) | Peptidyl-prolyl cis-trans isomerase Pin1,PPIase Pin1,Rotamase Pin1 |
| 2 | C, D (A, B) | methyl (~{E})-4-[[(3~{R})-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-4-oxidanylidene-but-2-enoate | non-polymer | 247.3 | 2 | Chemie (A1D9T) | |||
| 3 | E, F (A, B) | water | water | 18.0 | 178 | Chemie (HOH) |
Sequence modifications
A, B: 45 - 163 (UniProt: Q13526)
| PDB | External Database | Details |
|---|---|---|
| Gly 43 | - | expression tag |
| Pro 44 | - | expression tag |
| Gln 77 | Lys 77 | conflict |
| Gln 82 | Lys 82 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 26805.8 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 494.5 | |
| All* | Total formula weight | 27300.3 |
