9IFF
PANDDA analysis - Crystal structure of Trypanosoma brucei trypanothione reductase in complex with Z2856434836
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, K, P, U (A, B, C, D) | FLAVIN-ADENINE DINUCLEOTIDE | non-polymer | 785.5 | 4 | Chemie (FAD) | |||
| 3 | F, L, Q, T, V (A, B, C, D) | IMIDAZOLE | non-polymer | 69.1 | 5 | Chemie (IMD) | |||
| 4 | G, H, R, S, W (A, C, D) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 5 | Chemie (PEG) | |||
| 5 | I, J, N, O, X... (A, B, D) | BROMIDE ION | non-polymer | 79.9 | 6 | Chemie (BR) | |||
| 6 | M (B) | 2-(4-methylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone | non-polymer | 249.3 | 1 | Chemie (LPZ) | |||
| 7 | AA, BA, CA, Z (B, C, D, A) | water | water | 18.0 | 915 | 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 | 21 |
| Total formula weight | 4747.0 | |
| All* | Total formula weight | 218738.9 |
