MolNFT v1 · #106507 · protein
Crystal structure of cyclophilin mutant L120A from leishmania donovani at 2.22 ångström.
4S1E · Peptidyl-prolyl cis-trans isomerase: “Crystal structure of cyclophilin mutant L120A from leishmania donovani at 2.22 ångström.”. X-ray diffraction, 2 pockets (best druggability 0.41). MolNFT v1 #106507 on GenesisL1: 3D structure…
- PDB
- 4S1E
- Type
- protein
- Length
- 332 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Peptidyl-prolyl cis-trans isomerase
- EC
- 5.2.1.8
- UniProt
- Q9U9R3
- Pockets
- 2 · best druggability 0.41
Structure
x-ray diffraction · 1 distinct chain · 14% helix, 31% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Peptidyl-prolyl cis-trans isomerase (EC 5.2.1.8) | protein | 166 | 14% helix, 31% strand | Q9U9R3 |
Pockets
2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 145 | 0.41 | 0.74 | 26 | empty |
| 2 | 59 | 0.30 | 0.75 | 19 | empty |
Interfaces
1 interface between chains.
- A–B · 45 Ų buried · 1 hydrogen bond · protein-protein
Compared structures
- 4S1E · Crystal structure of cyclophilin mutant L120A from Leishmania donovani at 2.22 angstrom. · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q9U9R3
- Elsewhere: RCSB PDB 4S1E · PDBe 4S1E · UniProt Q9U9R3
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