Structure for darunavir (A02.001 inhibitor)

Summary Structure Literature

TERTIARY STRUCTURE DATA
Comment	Resolution	PDB	PDBe	SCOP	CATH	PDBSum	Proteopedia	Reference
feline immunodeficiency virus retropepsin ( feline immunodeficiency virus)
complex with darunavir	1.70 Å	3OGP	3OGP	3OGP	3OGP	3OGP	3OGP
HIV-1 retropepsin ( human immunodeficiency virus 1)
complex with TMC114 inhibitor	1.20 Å	1T3R	1T3R	1T3R	1T3R	1T3R	1T3R	Surleraux et al., 2005
Asp30Asn mutant; complex with inhibitor TMC114	1.45 Å	2F80	2F80	2F80	2F80	2F80	2F80
Leu90Met mutant; complex with inhibitor TMC114	1.25 Å	2F81	2F81	2F81	2F81	2F81	2F81
Ile50Val mutant; complex with inhibitor TMC114	1.22 Å	2F8G	2F8G	2F8G	2F8G	2F8G	2F8G
effect of flap mutations inhibition by saquinavir and darunavir	1.40 Å	3CYW	3CYW	3CYW	3CYW	3CYW	3CYW
Ile54Met mutant; complex with inhibitor darunavir	1.30 Å	3D1Z	3D1Z	3D1Z	3D1Z	3D1Z	3D1Z
multi-drug resistant variant (Leu10Phe/Gly48Val/Ile54Val/Val64Ile/Val82Ala); complex with darunavir (drv)	1.97 Å	3EKT	3EKT	3EKT	3EKT	3EKT	3EKT
Ile50Leu/Ala71val mutant; complex with inhibitor darunavir	2.10 Å	3EM6	3EM6	3EM6	3EM6	3EM6	3EM6
complex with darunavir	1.95 Å	3LZS	3LZS	3LZS	3LZS	3LZS	3LZS
nelfinavir resistant variant (Asn88Ser); complex with the protease inhibitor darunavir.	1.76 Å	3LZU	3LZU	3LZU	3LZU	3LZU	3LZU
nelfinavir-resistant variant (Asp30Asn/Asn88Asp); complex with darunavir.	2.15 Å	3LZV	3LZV	3LZV	3LZV	3LZV	3LZV
Ile50Val/Ala71Val variant; complex with the protease inhibitor darunavir	1.95 Å	3OXW	3OXW	3OXW	3OXW	3OXW	3OXW
Leu76Val variant; complex with the protease inhibitor darunavir.	1.76 Å	3OY4	3OY4	3OY4	3OY4	3OY4	3OY4
triple mutant Val32Ile/Ile47Val/Val82Ile; complex with antiviral drug darunavir in space group p212121	1.50 Å	3S53	3S53	3S53	3S53	3S53	3S53
triple mutant Val32Ile/Ile47Val/Val82Ile; complex with antiviral drug darunavir in space group p21212	1.42 Å	3S54	3S54	3S54	3S54	3S54	3S54
wild-type; complex with darunavir	1.95 Å	4LL3	4LL3	4LL3	4LL3	4LL3	4LL3
multidrug-resistant clinical isolate; complex with darunavir	1.95 Å	4NJT	4NJT	4NJT	4NJT	4NJT	4NJT
triple mutant (Val32Ile/Ile47Val/Val82Ile); complex with darunavir at ph 6.0	1.85 Å	5E5J	5E5J	5E5J	5E5J	5E5J	5E5J
nl4-3 wt; complex with darunavir	2.00 Å	6DGX	6DGX	6DGX	6DGX	6DGX	6DGX
nl4-3 v82i mutant; complex with darunavir	1.91 Å	6DH3	6DH3	6DH3	6DH3	6DH3	6DH3
nl4-3 i50v mutant; complex with darunavir	1.97 Å	6DH6	6DH6	6DH6	6DH6	6DH6	6DH6
HIV-2 retropepsin ( human immunodeficiency virus 2)
complex with clinical drug darunavir	1.20 Å	3EBZ	3EBZ	3EBZ	3EBZ	3EBZ	3EBZ