| SYSTEM |
HIV-1
PR
(BH10 isolate) with
penicillin derived C2-symmetric inhibitor
|
| HIVdb File |
hiv1glx
|
| PDB File |
1hte
|
| Company or Laboratory |
Glaxo Group Research
Limited
|
| Year |
1993
|
| INHIBITOR (Type) |
GR123976
(penicillin-derived C2-symmetric inhibitor)
|
| Composition of the Inhibitor
(Substrate) or Summary Formula |
(2R,4S) - 2 - [(R) -
benzylcarbamoyl - phenylacetylamino - methyl] -5,5 - dimethyl - thiazolidine
- 4 - carboxylic acid
|
| Resolution |
2.8Ao
|
| R factor |
0.161
|
| Space Group |
P21212
|
| Dimension of Elementary
Cell |
a=58.30,b=87.30,c=46.40
|
| a,b,g
(alpha,beta,gamma)
|
a=b=g=90
|
| Reference |
A.Wonacott, R. Cooke, F.R.Hayes,
M.M.Hann, H.Jhoti, P.McMeekin, M.P.Weir;
J.Med.Chem., 36, 3113, 1993 |
| Comment |
The conformations of the
side chains for residues Ser A37,Arg A 41,Lys A43, Glna A61, Ile A72 and
Ser B37 are unclear |