3EL0

Crystal structure of the inhibitor Nelfinavir (NFV) in complex with a multi-drug resistant HIV-1 protease variant (L10I/G48V/I54V/V64I/V82A) (Refer: FLAP+ in citation)

Summary for 3EL0

• Entry DOI: 10.2210/pdb3el0/pdb
• Related: 3EKP 3EKQ 3EKT 3EKV 3EKW 3EKX 3EKY 3EL1 3EL4 3EL5
• Descriptor: Protease, 2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE, PHOSPHATE ION, ... (5 entities in total)
• Functional Keywords: hiv-1, protease, multi-drug resistance, nelfinavir, aids, hydrolase
• Biological source: HIV-1 M:B_ARV2/SF2 (HIV-1)
• Cellular location: Matrix protein p17: Virion (Potential). Capsid protein p24: Virion (Potential). Nucleocapsid protein p7: Virion (Potential). Reverse transcriptase/ribonuclease H: Virion (Potential). Integrase: Virion (Potential): P03369
• Total number of polymer chains: 2
• Total formula weight: 22684.52

Authors

Prabu-Jeyabalan, M.,King, N.M. (deposition date: 2008-09-19, release date: 2009-09-01, Last modification date: 2024-02-21)

• Primary citation: King, N.M.,Prabu-Jeyabalan, M.,Bandaranayake, R.M.,Nalam, M.N.,Nalivaika, E.A.,Ozen, A.,Yilmaz, N.K.,Schiffer, C.A.; Extreme Entropy-Enthalpy Compensation in a Drug-Resistant Variant of HIV-1 Protease.; Acs Chem.Biol., 7:1536-1546, 2012; PubMed: 22712830; DOI: 10.1021/cb300191k

Experimental method

X-RAY DIFFRACTION (2 Å)