3CSI
Crystal Structure of the Glutathione Transferase Pi allelic variant*C, I104V/A113V, in complex with the Chlorambucil-Glutathione Conjugate
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) | Glutathione S-transferase P | polymer | 209 | 23260.6 | 4 | UniProt (P09211) Pfam (PF02798) Pfam (PF14497) | Homo sapiens (human) | GST class-pi, GSTP1-1 |
| 2 | E, L, P, U (A, B, C, D) | CHLORIDE ION | non-polymer | 35.5 | 4 | Chemie (CL) | |||
| 3 | F, M, V (A, B, D) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 3 | Chemie (MES) | |||
| 4 | G, N, Q, W (A, B, C, D) | L-gamma-glutamyl-S-(2-{[4-(3-carboxypropyl)phenyl](2-chloroethyl)amino}ethyl)-L-cysteinylglycine | non-polymer | 575.1 | 4 | Chemie (LZ6) | |||
| 5 | H, O, R, X (A, B, C, D) | GLUTATHIONE | non-polymer | 307.3 | 4 | Chemie (GSH) | |||
| 6 | I (B) | CARBONATE ION | non-polymer | 60.0 | 1 | Chemie (CO3) | |||
| 7 | J, S, T (B, D) | CALCIUM ION | non-polymer | 40.1 | 3 | Chemie (CA) | |||
| 8 | K (B) | SULFATE ION | non-polymer | 96.1 | 1 | Chemie (SO4) | |||
| 9 | AA, BA, Y, Z (C, D, A, B) | water | water | 18.0 | 902 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 209 (UniProt: P09211)
| PDB | External Database | Details |
|---|---|---|
| Val 104 | Ile 105 | engineered mutation |
| Val 113 | Ala 114 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 93042.4 | |
| Non-Polymers* | Number of molecules | 20 |
| Total formula weight | 4533.4 | |
| All* | Total formula weight | 97575.8 |
