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2FXE

X-ray crystal structure of HIV-1 protease CRM mutant complexed with atazanavir (BMS-232632)

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B
(A, B)
pol proteinpolymer9910725.72GenBank (21929323)
Pfam (PF00077)
UniProt (by SIFTS) (P05959)
Human immunodeficiency virus 1
2C, G, H
(A, B)
SULFATE IONnon-polymer96.13Chemie (SO4)
3D
(A)
ACETATE IONnon-polymer59.01Chemie (ACT)
4E
(A)
(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOIC ACID DIMETHYL ESTERnon-polymer704.91Chemie (DR7)
5F, I
(A, B)
GLYCEROLnon-polymer92.12Chemie (GOL)
6J, K
(A, B)
waterwater18.0225Chemie (HOH)
Sequence modifications
A, B: 1 - 99 (GenBank: 21929323)
PDBExternal DatabaseDetails
Lys 7Gln 7engineered mutation
Ile 10Leu 10engineered mutation
Val 13Ile 13engineered mutation
Ile 33Leu 33engineered mutation
Asn 37Ser 37engineered mutation
Lys 41Arg 41engineered mutation
Ile 63Leu 63engineered mutation
Ala 67Cys 67engineered mutation
Ala 95Cys 95engineered mutation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight21451.3
Non-Polymers*Number of molecules7
Total formula weight1236.3
All*Total formula weight22687.6
*Water molecules are not included.

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PDB entries from 2025-10-01

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