8AHF

PAC-FragmentDEL: Photoactivated covalent capture of DNA encoded fragments for hit discovery

Summary for 8AHF

Entry DOI	10.2210/pdb8ahf/pdb
Descriptor	UDP-N-acetylglucosamine 2-epimerase, (2~{R},4~{S})-4-[bis(fluoranyl)methoxy]-~{N}-methyl-1-(2~{H}-pyrazolo[4,3-b]pyridin-6-ylcarbonyl)pyrrolidine-2-carboxamide, SULFATE ION, ... (4 entities in total)
Functional Keywords	inhibitor, complex, epimerase, technology, isomerase
Biological source	Bacillus anthracis
Total number of polymer chains	2
Total formula weight	85571.25
Authors	Baker, L.M.,Murray, J.B.,Hubbard, R.E. (deposition date: 2022-07-21, release date: 2022-09-14, Last modification date: 2024-01-31)
Primary citation	Ma, H.,Murray, J.B.,Luo, H.,Cheng, X.,Chen, Q.,Song, C.,Duan, C.,Tan, P.,Zhang, L.,Liu, J.,Morgan, B.A.,Li, J.,Wan, J.,Baker, L.M.,Finnie, W.,Guetzoyan, L.,Harris, R.,Hendrickson, N.,Matassova, N.,Simmonite, H.,Smith, J.,Hubbard, R.E.,Liu, G. PAC-FragmentDEL - photoactivated covalent capture of DNA-encoded fragments for hit discovery. Rsc Med Chem, 13:1341-1349, 2022 Cited by PubMed: 36426238 DOI: 10.1039/d2md00197g PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.271 Å)

Structure validation