4BFY
Crystal structure of Mycobacterium tuberculosis PanK in complex with a biaryl inhibitory compound (2a) and phosphate
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | PANTOTHENATE KINASE | polymer | 318 | 36533.7 | 2 | UniProt (P63810) Pfam (PF00485) UniProt (by SIFTS) (P9WPA7) In PDB | MYCOBACTERIUM TUBERCULOSIS | PANTOTHENIC ACID KINASE |
2 | A, B | PHOSPHATE ION | non-polymer | 95.0 | 2 | Chemie (PO4) | |||
3 | A, B | 2-[4-(4-cyanophenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]acetic acid | non-polymer | 428.5 | 2 | Chemie (ZVY) | |||
4 | water | water | 18.0 | 210 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 312 (UniProt: P63810)
PDB | External Database | Details |
---|---|---|
His -5 | - | expression tag |
His -4 | - | expression tag |
His -3 | - | expression tag |
His -2 | - | expression tag |
His -1 | - | expression tag |
His 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 73067.5 | |
Non-Polymers* | Number of molecules | 4 |
Total formula weight | 1046.9 | |
All* | Total formula weight | 74114.4 |