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Atomistry » Chlorine » PDB 4rs3-4s25 » 4rw7 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 4rs3-4s25 » 4rw7 » |
Chlorine in PDB 4rw7: Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside InhibitorEnzymatic activity of Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor
All present enzymatic activity of Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor:
2.7.7.49; 2.7.7.7; 3.1.13.2; 3.1.26.13; Protein crystallography data
The structure of Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor, PDB code: 4rw7
was solved by
K.M.Frey,
K.S.Anderson,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor
(pdb code 4rw7). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor, PDB code: 4rw7: Chlorine binding site 1 out of 1 in 4rw7Go back to Chlorine Binding Sites List in 4rw7
Chlorine binding site 1 out
of 1 in the Crystal Structure of Hiv-1 Reverse Transcriptase (K103N, Y181C) Variant in Complex with (E)-3-(3-Chloro-5-(2-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenoxy)Phenyl)Acrylonitrile (JLJ532), A Non-Nucleoside Inhibitor
Mono view Stereo pair view
Reference:
K.M.Frey,
D.E.Puleo,
K.A.Spasov,
M.Bollini,
W.L.Jorgensen,
K.S.Anderson.
Structure-Based Evaluation of Non-Nucleoside Inhibitors with Improved Potency and Solubility That Target Hiv Reverse Transcriptase Variants. J.Med.Chem. V. 58 2737 2015.
Page generated: Sat Dec 12 11:12:25 2020
ISSN: ISSN 0022-2623 PubMed: 25700160 DOI: 10.1021/JM501908A |
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