3B2S
Crystal Structure of F. graminearum TRI101 complexed with Coenzyme A and Deoxynivalenol
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Trichothecene 3-O-acetyltransferase | polymer | 451 | 49449.1 | 1 | UniProt (Q9HDE2) Pfam (PF22664) UniProt (by SIFTS) (O42692) | Gibberella zeae | |
| 2 | B (A) | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
| 3 | C (A) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 4 | D (A) | COENZYME A | non-polymer | 767.5 | 1 | Chemie (COA) | |||
| 5 | E (A) | (3alpha,7alpha)-3,7,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one | non-polymer | 296.3 | 1 | Chemie (B2S) | |||
| 6 | F (A) | 3[N-MORPHOLINO]PROPANE SULFONIC ACID | non-polymer | 209.3 | 1 | Chemie (MPO) | |||
| 7 | G (A) | water | water | 18.0 | 427 | Chemie (HOH) |
Sequence modifications
A: 1 - 444 (UniProt: Q9HDE2)
| PDB | External Database | Details |
|---|---|---|
| Lys 445 | - | insertion |
| Tyr 446 | - | insertion |
| Ala 447 | - | insertion |
| Gln 448 | - | insertion |
| Tyr 449 | - | insertion |
| Val 450 | - | insertion |
| Gly 451 | - | insertion |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 49449.1 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 1320.4 | |
| All* | Total formula weight | 50769.5 |
