4CGI

Interrogating HIV integrase for compounds that bind- a SAMPL challenge

Summary for 4CGI

• Entry DOI: 10.2210/pdb4cgi/pdb
• Related: 4CGD 4CGF 4CGG 4CGH 4CGJ
• Descriptor: INTEGRASE, SULFATE ION, ACETATE ION, ... (5 entities in total)
• Functional Keywords: transferase, structure based drug design
• Biological source: HUMAN IMMUNODEFICIENCY VIRUS 1
• Total number of polymer chains: 2
• Total formula weight: 41632.79

Authors

Peat, T.S. (deposition date: 2013-11-25, release date: 2013-12-04, Last modification date: 2023-12-20)

• Primary citation: Peat, T.S.,Dolezal, O.,Newman, J.,Mobley, D.,Deadman, J.J.; Interrogating HIV Integrase for Compounds that Bind- a Sampl Challenge.; J.Comput.Aided Mol.Des., 28:347-, 2014; PubMed: 24532034; DOI: 10.1007/S10822-014-9721-7

Experimental method

X-RAY DIFFRACTION (2.07 Å)