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8P63	S. cerevisiae consensus-sCMGE on ssDNA after DNA replication initiation Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Cell division control protein 45, ... Authors: Henrikus, S.S, Willhoft, O. Deposit date: 2023-05-25 Release date: 2024-05-29 Last modified: 2024-08-28 Method: ELECTRON MICROSCOPY (3.7 Å) Cite: Unwinding of a eukaryotic origin of replication visualized by cryo-EM. Nat.Struct.Mol.Biol., 31, 2024
8P62	S. cerevisiae ssDNA-sCMGE after DNA replication initiation Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Cell division control protein 45, ... Authors: Henrikus, S.S, Willhoft, O. Deposit date: 2023-05-25 Release date: 2024-05-29 Last modified: 2024-08-28 Method: ELECTRON MICROSCOPY (3.9 Å) Cite: Unwinding of a eukaryotic origin of replication visualized by cryo-EM. Nat.Struct.Mol.Biol., 31, 2024
3UF8	Crystal structure of a SMT fusion Peptidyl-prolyl cis-trans isomerase with a G95A surface mutation from Burkholderia pseudomallei complexed with FK506 Descriptor: 8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN, Ubiquitin-like protein SMT3, Peptidyl-prolyl cis-trans isomerase Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2011-10-31 Release date: 2011-11-09 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.5 Å) Cite: A structural biology approach enables the development of antimicrobials targeting bacterial immunophilins. Antimicrob.Agents Chemother., 58, 2014
4NHM	Crystal structure of Tpa1p from Saccharomyces cerevisiae, termination and polyadenylation protein 1, in complex with N-[(1-chloro-4-hydroxyisoquinolin-3-yl)carbonyl]glycine (IOX3/UN9) Descriptor: GLYCEROL, MANGANESE (II) ION, N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE, ... Authors: Scotti, J.S, McDonough, M.A, Schofield, C.J. Deposit date: 2013-11-05 Release date: 2014-11-19 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Structure of the Ribosomal Oxygenase OGFOD1 Provides Insights into the Regio- and Stereoselectivity of Prolyl Hydroxylases. Structure, 23, 2015
5GAS	Thermus thermophilus V/A-ATPase, conformation 2 Descriptor: Archaeal/vacuolar-type H+-ATPase subunit I, V-type ATP synthase alpha chain, V-type ATP synthase beta chain, ... Authors: Schep, D.G, Zhao, J, Rubinstein, J.L. Deposit date: 2016-02-05 Release date: 2016-03-09 Last modified: 2024-03-06 Method: ELECTRON MICROSCOPY (9.5 Å) Cite: Models for the a subunits of the Thermus thermophilus V/A-ATPase and Saccharomyces cerevisiae V-ATPase enzymes by cryo-EM and evolutionary covariance. Proc.Natl.Acad.Sci.USA, 113, 2016
3UQA	Crystal structure of a SMT fusion Peptidyl-prolyl cis-trans isomerase with surface mutation A54E from Burkholderia pseudomallei complexed with FK506 Descriptor: 8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2011-11-19 Release date: 2011-12-07 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.55 Å) Cite: A structural biology approach enables the development of antimicrobials targeting bacterial immunophilins. Antimicrob.Agents Chemother., 58, 2014
5HJZ	Structure of M. tuberculosis MazF-mt1 (Rv2801c) in complex with RNA Descriptor: Endoribonuclease MazF9, RNA (5'-R(*CP*AP*UP*C)-D(P*U)-R(P*AP*CP*CP*UP*GP*A)-3') Authors: Yen, T.J, Brennan, R.G. Deposit date: 2016-01-13 Release date: 2017-01-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (1.976 Å) Cite: Structure of M. tuberculosis MazF-mt1 (Rv2801c) in complex with RNA To Be Published
5HK3	Crystal structure of M. tuberculosis MazF-mt3 T52D-F62D mutant in complex with DNA Descriptor: DNA (5'-D(*AP*GP*UP*CP*UP*CP*CP*UP*UP*UP*C)-3'), Endoribonuclease MazF6 Authors: Yen, T.J, Brennan, R.G. Deposit date: 2016-01-13 Release date: 2017-01-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (1.56 Å) Cite: Crystal structure of M. tuberculosis MazF-mt3 T52D-F62D mutant in complex with DNA To Be Published
5HKC	Crystal structure of M. tuberculosis MazF-mt3 T52D-F62D mutant in complex with 8-mer RNA Descriptor: Endoribonuclease MazF6, RNA (5'-R(*GP*UP*C)-D(P*U)-R(P*CP*CP*UP*A)-3') Authors: Yen, T.J, Brennan, R.G. Deposit date: 2016-01-14 Release date: 2017-01-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (1.68 Å) Cite: Crystal structure of M. tuberculosis MazF-mt3 T52D-F62D mutant in complex with 8-mer RNA To Be Published
8QEB	S. cerevisia Niemann-Pick type C protein NCR1 in GDN at pH 7.5 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL HEMISUCCINATE, ERGOSTEROL, ... Authors: Frain, K.M, Dedic, E, Nel, L, Olesen, E, Stokes, D, Panyella Pedersen, B. Deposit date: 2023-08-31 Release date: 2023-10-18 Last modified: 2024-11-13 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: Conformational changes in the Niemann-Pick type C1 protein NCR1 drive sterol translocation. Proc.Natl.Acad.Sci.USA, 121, 2024
4NZU	Crystal structure of the primary monoclonal antibody 13PL Fab' from a multiple myeloma patient Descriptor: 13PL heavy chain, 13PL light chain, ACETATE ION, ... Authors: Zhu, X, Wilson, I.A. Deposit date: 2013-12-12 Release date: 2014-02-19 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (1.2 Å) Cite: A structurally distinct human mycoplasma protein that generically blocks antigen-antibody union. Science, 343, 2014
8QED	S. cerevisia Niemann-Pick type C protein NCR1 in LMNG at pH 5.5 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ERGOSTEROL, NPC intracellular sterol transporter 1-related protein 1, ... Authors: Frain, K.M, Nel, L, Dedic, E, Olesen, E, Stokes, D, Panyella Pedersen, B. Deposit date: 2023-08-31 Release date: 2023-10-18 Last modified: 2024-11-06 Method: ELECTRON MICROSCOPY (3.27 Å) Cite: Conformational changes in the Niemann-Pick type C1 protein NCR1 drive sterol translocation. Proc.Natl.Acad.Sci.USA, 121, 2024
8QEE	S. cerevisia Niemann-Pick type C protein NCR1 in Peptidisc at pH 7.5 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL HEMISUCCINATE, ... Authors: Frain, K.M, Dedic, E, Nel, L, Olesen, E, Stokes, D, Panyella Pedersen, B. Deposit date: 2023-08-31 Release date: 2023-10-18 Last modified: 2024-11-13 Method: ELECTRON MICROSCOPY (2.43 Å) Cite: Conformational changes in the Niemann-Pick type C1 protein NCR1 drive sterol translocation. Proc.Natl.Acad.Sci.USA, 121, 2024
8QEC	S. cerevisia Niemann-Pick type C protein NCR1 in GDN at pH 5.5 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-{[(4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranosyl)oxy]methyl}-4-{[(3beta,9beta,14beta,17beta,25R)-spirost-5-en-3-yl]oxy}butyl 4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranoside, CHOLESTEROL HEMISUCCINATE, ... Authors: Frain, K.M, Dedic, E, Nel, L, Olesen, E, Stokes, D, Panyella Pedersen, B. Deposit date: 2023-08-31 Release date: 2023-10-18 Last modified: 2024-10-23 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: Conformational changes in the Niemann-Pick type C1 protein NCR1 drive sterol translocation. Proc.Natl.Acad.Sci.USA, 121, 2024
4O1L	Human Adenosine Kinase in complex with inhibitor Descriptor: 5-ethynyl-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, Adenosine kinase, MAGNESIUM ION Authors: Brynda, J, Dostal, J, Pichova, I, Hodcek, M. Deposit date: 2013-12-16 Release date: 2014-11-26 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structural Basis for Inhibition of Mycobacterial and Human Adenosine Kinase by 7-Substituted 7-(Het)aryl-7-deazaadenine Ribonucleosides J.Med.Chem., 57, 2014
5Y63	Crystal structure of Enterococcus faecalis AhpC Descriptor: Alkyl hydroperoxide reductase, C subunit Authors: Pan, A, Balakrishna, A.M, Grueber, G. Deposit date: 2017-08-10 Release date: 2017-12-27 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (2.87 Å) Cite: Atomic structure and enzymatic insights into the vancomycin-resistant Enterococcus faecalis (V583) alkylhydroperoxide reductase subunit C Free Radic. Biol. Med., 115, 2017
5GAR	Thermus thermophilus V/A-ATPase, conformation 1 Descriptor: Archaeal/vacuolar-type H+-ATPase subunit I, V-type ATP synthase alpha chain, V-type ATP synthase beta chain, ... Authors: Schep, D.G, Zhao, J, Rubinstein, J.L. Deposit date: 2016-02-05 Release date: 2016-03-09 Last modified: 2024-03-06 Method: ELECTRON MICROSCOPY (6.4 Å) Cite: Models for the a subunits of the Thermus thermophilus V/A-ATPase and Saccharomyces cerevisiae V-ATPase enzymes by cryo-EM and evolutionary covariance. Proc.Natl.Acad.Sci.USA, 113, 2016
2LJL	NMR structure of Hsp12 in the presence of DPC Descriptor: 12 kDa heat shock protein Authors: Singarapu, K, Markley, J, Center for Eukaryotic Structural Genomics (CESG) Deposit date: 2011-09-20 Release date: 2011-10-12 Last modified: 2024-05-15 Method: SOLUTION NMR Cite: Structural characterization of Hsp12, the heat shock protein from Saccharomyces cerevisiae, in aqueous solution where it is intrinsically disordered and in detergent micelles where it is locally alpha-helical. J.Biol.Chem., 286, 2011
5HK0	Crystal structure of M. tuberculosis MazF-mt3 (Rv1991c) in complex with RNA Descriptor: Endoribonuclease MazF6, RNA (5'-R(*AP*GP*UP*C)-D(P*U)-R(P*CP*CP*UP*UP*UP*C)-3') Authors: Yen, T.J, Brennan, R.G. Deposit date: 2016-01-13 Release date: 2017-01-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.25 Å) Cite: Crystal structure of M. tuberculosis MazF-mt3 (Rv1991c) in complex with RNA To Be Published
5TGM	Crystal structure of the S.cerevisiae 80S ribosome in complex with the A-site bound aminoacyl-tRNA analog ACCA-Pro Descriptor: 18S ribosomal RNA, 25S ribosomal RNA, 3'-amino-3'-deoxyadenosine 5'-(dihydrogen phosphate), ... Authors: Melnikov, S, Mailliot, J, Yusupov, M. Deposit date: 2016-09-28 Release date: 2017-01-18 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (3.5 Å) Cite: Molecular insights into protein synthesis with proline residues. EMBO Rep., 17, 2016
5MTQ	Crystal structure of M. tuberculosis InhA inhibited by PT511 Descriptor: 2-[4-[(4-cyclohexyl-1,2,3-triazol-1-yl)methyl]-2-oxidanyl-phenoxy]benzenecarbonitrile, Enoyl-[acyl-carrier-protein] reductase [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE Authors: Eltschkner, S, Pschibul, A, Spagnuolo, L.A, Yu, W, Tonge, P.J, Kisker, C. Deposit date: 2017-01-10 Release date: 2017-02-15 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Evaluating the Contribution of Transition-State Destabilization to Changes in the Residence Time of Triazole-Based InhA Inhibitors. J. Am. Chem. Soc., 139, 2017
5UAQ	Escherichia coli RNA polymerase RpoB H526Y mutant Descriptor: DNA-directed RNA polymerase subunit alpha, DNA-directed RNA polymerase subunit beta, DNA-directed RNA polymerase subunit beta', ... Authors: Molodtsov, V, Scharf, N.T, Stefan, M.A, Garcia, G.A, Murakami, K.S. Deposit date: 2016-12-19 Release date: 2017-01-11 Last modified: 2024-03-06 Method: X-RAY DIFFRACTION (3.6 Å) Cite: Structural basis for rifamycin resistance of bacterial RNA polymerase by the three most clinically important RpoB mutations found in Mycobacterium tuberculosis. Mol. Microbiol., 103, 2017
6F9H	Crystal structure of Barley Beta-Amylase complexed with 4-S-alpha-D-glucopyranosyl-(1,4-dideoxy-4-thio-nojirimycin) Descriptor: 1,4-dideoxy-4-thio-nojirimycin, Beta-amylase, CHLORIDE ION, ... Authors: Moncayo, M.A, Rodrigues, L.L, Stevenson, C.E.M, Ruzanski, C, Rejzek, M, Lawson, D.M, Angulo, J, Field, R.A. Deposit date: 2017-12-14 Release date: 2019-01-30 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Synthesis, biological and structural analysis of prospective glycosyl-iminosugar prodrugs: impact on germination To be published
5UAJ	Escherichia coli RNA polymerase RpoB S531L mutant Descriptor: DNA-directed RNA polymerase subunit alpha, DNA-directed RNA polymerase subunit beta, DNA-directed RNA polymerase subunit beta', ... Authors: Molodtsov, V, Scharf, N.T, Stefan, M.A, Garcia, G.A, Murakami, K.S. Deposit date: 2016-12-19 Release date: 2017-01-11 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (3.915 Å) Cite: Structural basis for rifamycin resistance of bacterial RNA polymerase by the three most clinically important RpoB mutations found in Mycobacterium tuberculosis. Mol. Microbiol., 103, 2017
8CLV	Zearalenone lactonase of Rhodococcus erythropolis in complex with hydrolyzed zearalenone Descriptor: 2,4-dihydroxy-6-[(1E,10S)-10-hydroxy-6-oxoundec-1-en-1-yl]benzoic acid, Zearalenone lactonase Authors: Puehringer, D. Deposit date: 2023-02-17 Release date: 2024-02-28 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.54 Å) Cite: Bacterial Lactonases ZenA with Noncanonical Structural Features Hydrolyze the Mycotoxin Zearalenone. Acs Catalysis, 14, 2024

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