4B75
Discovery of an allosteric mechanism for the regulation of HCV NS3 protein function
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | NON-STRUCTURAL PROTEIN 4A, SERINE PROTEASE NS3 | polymer | 666 | 70883.4 | 2 | UniProt (P26663) Pfam (PF02907) Pfam (PF07652) Pfam (PF22027) In PDB | HEPATITIS C VIRUS (ISOLATE BK) | HCV NS3 4A, NS4A, P8, HEPACIVIRIN, NS3P, P70 |
2 | A, B | (2S)-4-amino-N-[(1R)-1-(4-chloro-2-fluoro-3-phenoxyphenyl)propyl]-4-oxobutan-2-aminium | non-polymer | 365.9 | 2 | Chemie (4VA) | |||
3 | water | water | 18.0 | 405 | Chemie (HOH) |
Sequence modifications
A, B: 705 - 717 (UniProt: P26663)
A, B: 3 - 631 (UniProt: P26663)
PDB | External Database | Details |
---|---|---|
Met 684 | - | expression tag |
Gly 685 | - | expression tag |
Ser 686 | - | expression tag |
Ser 687 | - | expression tag |
His 688 | - | expression tag |
His 689 | - | expression tag |
His 690 | - | expression tag |
His 691 | - | expression tag |
His 692 | - | expression tag |
His 693 | - | expression tag |
Ser 694 | - | expression tag |
Ser 695 | - | expression tag |
Gly 696 | - | expression tag |
Leu 697 | - | expression tag |
Val 698 | - | expression tag |
Pro 699 | - | expression tag |
Arg 700 | - | expression tag |
Gly 701 | - | expression tag |
Ser 702 | - | expression tag |
His 703 | - | expression tag |
Met 704 | - | expression tag |
PDB | External Database | Details |
---|---|---|
Ser 718 | - | linker |
Gly 719 | - | linker |
Ser 720 | - | linker |
Gly 66 | Ala 1092 | conflict |
Gln 86 | Pro 1112 | conflict |
Ala 87 | Lys 1113 | conflict |
Ser 147 | Phe 1173 | conflict |
Leu 630 | Val 1656 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 141766.8 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 731.7 | |
All* | Total formula weight | 142498.5 |