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PDBe Entry: 2o8m 
Crystal structure of the S139A mutant of Hepatitis C Virus NS3/4A protease
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Viral Protein
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X-RAY DIFFRACTION
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Resolution: 2.0 Å, R-factor: 19.6%, Free R-factor: 22.8%, Spacegroup: H 3 2
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09/10/2007, deposition: 12/12/2006, last revision: 24/02/2009
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Fischmann, T.O.; Prongay, A.J.; Madison, V.M.; Yao, N.
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Discovery of the HCV NS3/4A protease inhibitor (1R,5S)-N-[3-amino-1-(cyclobutylmethyl)-2,3-dioxopropyl]-3- [2(S)-[[[(1,1-dimethylethyl)amino]carbonyl]amino]-3,3-dimethyl-1-oxobutyl]- 6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2(S)-carboxamide (Sch 503034) II. Key steps in structure-based optimization
J.MED.CHEM. vol:50, pag:2310-2318 (2007) [PubMed ID 17444623 ]
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SERINE PROTEASE, NS3, NS4A, HEPATITIS C VIRUS, Viral Protein
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2.7.7.48 ExPASy BRENDA 3.4.21.98 ExPASy BRENDA 3.6.1.15 ExPASy BRENDA (C D)
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Hepatitis C virus 11103(A B)
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Polyprotein,Genome polyprotein Q9ELS8 (A B)
Genome polyprotein [Contains: Core protein p21 (Capsid protein C) (p21); Core protein p19; Envelope glycoprotein E1 (gp32) (gp35); Envelope glycoprotein E2 (NS1) (gp68) (gp70); p7; Protease NS2-3 (EC 3.4.22.-) (p23); Serine protease/NTPase/helicase NS3 (EC 3.4.21.98) (EC 3.6.1.15) (EC 3.6.1.-) (Hepacivirin) (NS3P) (p70); Non-structural protein 4A (NS4A) (p8); Non-structural protein 4B (NS4B) (p27); Non-structural protein 5A (NS5A) (p56); RNA-directed RNA polymerase (EC 2.7.7.48) (NS5B) (p68)] P27958 (C D)
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A, B, C, D
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| A, B |
Protease |
Protein |
Q9ELS8 (Q9ELS8_9HEPC)
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200 |
92% |
| C, D |
Protease |
Protein |
P27958 (POLG_HCVH)
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23 |
100% |
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| A, B |
ZINC ION |
ZN
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| C, A |
SODIUM ION |
NA
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