6WC8
HIV Integrase core domain in complex with inhibitor 2-(5-(3-fluorophenyl)-2-(2-(thiophen-2-yl)ethynyl)-1- benzofuran-3-yl)ethanoic acid
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Integrase | polymer | 165 | 18001.5 | 1 | UniProt (F2WR52) Pfam (PF00665) In PDB | Human immunodeficiency virus 1 (HIV-1) | |
2 | A | {5-(3-fluorophenyl)-2-[(thiophen-2-yl)ethynyl]-1-benzofuran-3-yl}acetic acid | non-polymer | 376.4 | 1 | Chemie (TQM) | |||
3 | A | IODIDE ION | non-polymer | 126.9 | 4 | Chemie (IOD) | |||
4 | A | SULFATE ION | non-polymer | 96.1 | 4 | Chemie (SO4) | |||
5 | water | water | 18.0 | 26 | Chemie (HOH) |
Sequence modifications
A: 50 - 212 (UniProt: F2WR52)
PDB | External Database | Details |
---|---|---|
Gly 48 | - | expression tag |
Ser 49 | - | expression tag |
Glu 53 | Gln 53 | engineered mutation |
Glu 131 | Trp 131 | engineered mutation |
Lys 185 | Phe 185 | engineered mutation |
Glu 209 | Gln 209 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 18001.5 | |
Non-Polymers* | Number of molecules | 9 |
Total formula weight | 1268.3 | |
All* | Total formula weight | 19269.8 |