7SO3

Crystal Structure of HIV-1 Reverse Transcriptase K103N/Y181C Variant in Complex with (E)-4-((4-((4-(2-cyanovinyl)-2,6-dimethylphenyl)amino)-6-(3-morpholinopropoxy)-1,3,5-triazin-2-yl)amino)benzonitrile (JLJ564)

Summary for 7SO3

• Entry DOI: 10.2210/pdb7so3/pdb
• Related: 7SNP 7SNZ 7SO1 7SO2
• Descriptor: Reverse transcriptase/ribonuclease H, p51 RT, 4-[(4-{4-[(E)-2-cyanoethenyl]-2,6-dimethylanilino}-6-[3-(morpholin-4-yl)propoxy]-1,3,5-triazin-2-yl)amino]benzonitrile, ... (5 entities in total)
• Functional Keywords: polymerase, transferase, hydrolase, rnaseh, transferase-viral protein complex, transferase/viral protein
• Biological source: Human immunodeficiency virus type 1 group M subtype B (isolate BH10) (HIV-1); More
• Total number of polymer chains: 2
• Total formula weight: 114488.51

Authors

Frey, K.M.,Anderson, K.S. (deposition date: 2021-10-29, release date: 2022-03-16, Last modification date: 2023-10-18)

• Primary citation: Frey, K.M.,Bertoletti, N.,Chan, A.H.,Ippolito, J.A.,Bollini, M.,Spasov, K.A.,Jorgensen, W.L.,Anderson, K.S.; Structural Studies and Structure Activity Relationships for Novel Computationally Designed Non-nucleoside Inhibitors and Their Interactions With HIV-1 Reverse Transcriptase.; Front Mol Biosci, 9:805187-805187, 2022; PubMed: 35237658; DOI: 10.3389/fmolb.2022.805187

Experimental method

X-RAY DIFFRACTION (2.767 Å)