7JMQ
The external aldimine form of the mutant beta-S377A Salmonella thypi tryptophan synthase in open conformation showing dual side chain conformations for the residue beta-Q114, sodium ion at the metal coordination site, and F9 inhibitor at the alpha-site. One of the beta-Q114 rotamer conformations allows a hydrogen bond to form with the PLP oxygen at the position 3 in the ring
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Tryptophan synthase alpha chain | polymer | 268 | 28698.8 | 1 | UniProt (P00929) Pfam (PF00290) In PDB | Salmonella typhimurium (strain LT2 / SGSC1412 / ATCC 700720) | |
2 | B | Tryptophan synthase beta chain | polymer | 397 | 42902.9 | 1 | UniProt (P0A2K1) Pfam (PF00291) In PDB | Salmonella typhimurium (strain LT2 / SGSC1412 / ATCC 700720) | |
3 | B, A | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 33 | Chemie (DMS) | |||
4 | A | 2-({[4-(TRIFLUOROMETHOXY)PHENYL]SULFONYL}AMINO)ETHYL DIHYDROGEN PHOSPHATE | non-polymer | 365.2 | 1 | Chemie (F9F) | |||
5 | A, B | CESIUM ION | non-polymer | 132.9 | 2 | Chemie (CS) | |||
6 | B | (E)-N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-serine | non-polymer | 334.2 | 1 | Chemie (KOU) | |||
7 | B | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
8 | B | 1,2-ETHANEDIOL | non-polymer | 62.1 | 2 | Chemie (EDO) | |||
9 | B | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
10 | B | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) | |||
11 | water | water | 18.0 | 794 | Chemie (HOH) |
Sequence modifications
B: 1 - 397 (UniProt: P0A2K1)
PDB | External Database | Details |
---|---|---|
Ala 377 | Ser 377 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 71601.7 | |
Non-Polymers* | Number of molecules | 43 |
Total formula weight | 3910.4 | |
All* | Total formula weight | 75512.1 |