9IFL
PANDDA analysis - Crystal structure of Trypanosoma brucei trypanothione reductase in complex with Z319545618
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D (A, B, C, D) | Trypanothione reductase | polymer | 495 | 53498.0 | 4 | UniProt (Q389T8) Pfam (PF07992) Pfam (PF02852) | Trypanosoma brucei | N(1),N(8)-bis(glutathionyl)spermidine reductase |
| 2 | E, M, R, X (A, B, C, D) | FLAVIN-ADENINE DINUCLEOTIDE | non-polymer | 785.5 | 4 | Chemie (FAD) | |||
| 3 | F, J, N, S, W... (A, B, C, D) | IMIDAZOLE | non-polymer | 69.1 | 6 | Chemie (IMD) | |||
| 4 | G, H, K, P, T... (A, B, C, D) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 7 | Chemie (PEG) | |||
| 5 | AA, I, O, V (D, A, B, C) | 3-[(2-methyl-1H-imidazol-1-yl)methyl]benzonitrile | non-polymer | 197.2 | 4 | Chemie (RXS) | |||
| 6 | L, Q (A, B) | BROMIDE ION | non-polymer | 79.9 | 2 | Chemie (BR) | |||
| 7 | BA (D) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 8 | CA, DA, EA, FA (A, B, C, D) | water | water | 18.0 | 1040 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 492 (UniProt: Q389T8)
| PDB | External Database | Details |
|---|---|---|
| Gly -2 | - | expression tag |
| Ser -1 | - | expression tag |
| His 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 213991.9 | |
| Non-Polymers* | Number of molecules | 24 |
| Total formula weight | 5271.3 | |
| All* | Total formula weight | 219263.2 |
