PDB: 47720 resultsInfo pagesStatus searchChemie searchBIRD

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4DIP	Crystal structure of human Peptidyl-prolyl cis-trans isomerase FKBP14 Descriptor: PHOSPHATE ION, Peptidyl-prolyl cis-trans isomerase FKBP14, SODIUM ION Authors: Krojer, T, Kiyani, W, Goubin, S, Muniz, J.R.C, Filippakopoulos, P, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Oppermann, U, Zschocke, J, Yue, W.W, Structural Genomics Consortium (SGC) Deposit date: 2012-01-31 Release date: 2012-02-22 Method: X-RAY DIFFRACTION (1.82 Å) Cite: Crystal structure of human Peptidyl-prolyl cis-trans isomerase FKBP14 To be Published
5UCA	Crystal structure of human Heme Oxygenase-2 in complex with Laurate Descriptor: Heme oxygenase 2, LAURIC ACID Authors: Luo, S, Tong, L. Deposit date: 2016-12-22 Release date: 2017-02-15 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.117 Å) Cite: Heme Oxygenase 2 Binds Myristate to Regulate Retrovirus Assembly and TLR4 Signaling. Cell Host Microbe, 21, 2017
5UDV	LarE, a sulfur transferase involved in synthesis of the cofactor for lactate racemase, in complex with iron Descriptor: FE (III) ION, Lactate racemization operon protein LarE, PHOSPHATE ION, ... Authors: Fellner, M, Desguin, B, Hausinger, R.P, Hu, J. Deposit date: 2016-12-28 Release date: 2017-08-23 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.621 Å) Cite: Structural insights into the catalytic mechanism of a sacrificial sulfur insertase of the N-type ATP pyrophosphatase family, LarE. Proc. Natl. Acad. Sci. U.S.A., 114, 2017
4DQG	Crystal Structure of apo(G16C/L38C) HIV-1 Protease Descriptor: ACETATE ION, Aspartyl protease, GLYCEROL, ... Authors: Schiffer, C.A, Mittal, S. Deposit date: 2012-02-15 Release date: 2012-03-07 Last modified: 2017-11-15 Method: X-RAY DIFFRACTION (2.79 Å) Cite: Hydrophobic core flexibility modulates enzyme activity in HIV-1 protease. J.Am.Chem.Soc., 134, 2012
5CGG	Yeast 20S proteasome beta5-G48C mutant in complex with alpha-chloroacetamide 1 Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, MAGNESIUM ION, ... Authors: Dubiella, C, Groll, M. Deposit date: 2015-07-09 Release date: 2015-11-25 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Selective Inhibition of the Immunoproteasome by Structure-Based Targeting of a Non-catalytic Cysteine. Angew.Chem.Int.Ed.Engl., 54, 2015
5UHG	Crystal structure of Mycobacterium tuberculosis transcription initiation complex in complex with D-AAP1 and Rifampin Descriptor: DNA (5'-D(*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*CP*CP*AP*GP*G)-3'), DNA (5'-D(*TP*AP*TP*AP*AP*TP*GP*GP*GP*AP*GP*CP*TP*GP*TP*CP*AP*CP*GP*GP*AP*TP*G)-3'), DNA-directed RNA polymerase subunit alpha, ... Authors: Lin, W, Das, K, Feng, Y, Ebright, R.H. Deposit date: 2017-01-11 Release date: 2017-04-12 Last modified: 2017-11-22 Method: X-RAY DIFFRACTION (3.971 Å) Cite: Structural Basis of Mycobacterium tuberculosis Transcription and Transcription Inhibition. Mol. Cell, 66, 2017
4J70	Yeast 20S proteasome in complex with the belactosin derivative 3e Descriptor: Proteasome component C1, Proteasome component C11, Proteasome component C5, ... Authors: Kawamura, S, Unno, Y, List, A, Tanaka, M, Sasaki, T, Arisawa, M, Asai, A, Groll, M, Shuto, S. Deposit date: 2013-02-12 Release date: 2013-04-17 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Potent Proteasome Inhibitors Derived from the Unnatural cis-Cyclopropane Isomer of Belactosin A: Synthesis, Biological Activity, and Mode of Action. J.Med.Chem., 56, 2013
5TR9	Crystal Structure of a ferredoxin NADP+ reductase from Neisseria gonorrhoeae with bound FAD Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2016-10-25 Release date: 2016-11-09 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Crystal Structure of a ferredoxin NADP+ reductase from Neisseria gonorrhoeae with bound FAD to be published
4DQK	Crystal structure of the FAD binding domain of cytochrome P450 BM3 Descriptor: Bifunctional P-450/NADPH-P450 reductase, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, ... Authors: Joyce, M.G, Leys, D. Deposit date: 2012-02-16 Release date: 2012-03-07 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.4 Å) Cite: The crystal structure of the FAD/NADPH-binding domain of flavocytochrome P450 BM3. Febs J., 279, 2012
4Y69	Yeast 20S proteasome in complex with Ac-PAD-ep Descriptor: Ac-PAD-ep, CHLORIDE ION, MAGNESIUM ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-12 Release date: 2015-06-17 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
4JDE	Crystal structure of PUD-1/PUD-2 heterodimer Descriptor: CHLORIDE ION, GLYCEROL, Protein F15E11.1, ... Authors: Luo, S, Ye, K. Deposit date: 2013-02-25 Release date: 2013-11-06 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Characterization of PUD-1 and PUD-2, two proteins up-regulated in a long-lived daf-2 mutant. Plos One, 8, 2013
4Y81	Yeast 20S proteasome in complex with Ac-PAY-ep Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Ac-PAY-ep, CHLORIDE ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-16 Release date: 2015-06-17 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
4Y8Q	Yeast 20S proteasome beta7-delta7_Cter mutant in complex with Ac-PAY-ep Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Ac-PAY-ep, CHLORIDE ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-16 Release date: 2015-06-17 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
4Y75	Yeast 20S proteasome in complex with Ac-PAF-ep Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Ac-PAF-ep, CHLORIDE ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-13 Release date: 2015-06-17 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
4YAK	Ca. Korarchaeum cryptofilum dinucleotide forming Acetyl-coenzyme A synthetase 1 in complex with coenzyme A, acetyl-coenzyme A and with phosphorylated phosphohistidine segment (site I orientation) Descriptor: ACETYL COENZYME *A, COENZYME A, alpha subunit of Acyl-CoA synthetase (NDP forming), ... Authors: Weisse, R.H.-J, Scheidig, A.J. Deposit date: 2015-02-17 Release date: 2016-01-27 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.464 Å) Cite: Structure of NDP-forming Acetyl-CoA synthetase ACD1 reveals a large rearrangement for phosphoryl transfer. Proc.Natl.Acad.Sci.USA, 113, 2016
4DWL	Avd molecule from Bordetella bacteriophage DGR Descriptor: Bbp7, PHOSPHATE ION Authors: Ghosh, P, Al-Ayyoubi, M. Deposit date: 2012-02-24 Release date: 2013-02-27 Last modified: 2015-01-14 Method: X-RAY DIFFRACTION (2.69 Å) Cite: Structure of the essential diversity-generating retroelement protein bAvd and its functionally important interaction with reverse transcriptase. Structure, 21, 2013
4Y8N	Yeast 20S proteasome beta7-delta7_Cter mutant in complex with Ac-PAE-ep Descriptor: Ac-PAE-ep, CHLORIDE ION, MAGNESIUM ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-16 Release date: 2015-06-17 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
5CGH	Yeast 20S proteasome beta5-G48C mutant in complex with alpha-chloroacetamide 5 Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, MAGNESIUM ION, ... Authors: Dubiella, C, Groll, M. Deposit date: 2015-07-09 Release date: 2015-12-02 Last modified: 2024-06-26 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Selective Inhibition of the Immunoproteasome by Structure-Based Targeting of a Non-catalytic Cysteine. Angew.Chem.Int.Ed.Engl., 54, 2015
4E0G	Protelomerase tela/DNA hairpin product/vanadate complex Descriptor: DNA (5'-D(*CP*AP*TP*AP*AP*TP*AP*AP*CP*AP*AP*TP*A)-3'), DNA (5'-D(*TP*CP*AP*TP*GP*AP*TP*AP*TP*TP*GP*TP*TP*AP*TP*TP*AP*TP*G)-3'), Protelomerase, ... Authors: Shi, K, Aihara, H. Deposit date: 2012-03-03 Release date: 2013-02-13 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.2 Å) Cite: An enzyme-catalyzed multistep DNA refolding mechanism in hairpin telomere formation. Plos Biol., 11, 2013
5UAL	Escherichia coli RNA polymerase and Rifampin complex, 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: 2024-03-06 Method: X-RAY DIFFRACTION (3.887 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
4KEW	structure of the A82F BM3 heme domain in complex with omeprazole Descriptor: 6-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-1H-benzimidazole, Bifunctional P-450/NADPH-P450 reductase, PROTOPORPHYRIN IX CONTAINING FE Authors: Leys, D. Deposit date: 2013-04-26 Release date: 2013-07-10 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.89 Å) Cite: Key Mutations Alter the Cytochrome P450 BM3 Conformational Landscape and Remove Inherent Substrate Bias. J.Biol.Chem., 288, 2013
4KI7	Design and structural analysis of aromatic inhibitors of type II dehydroquinase from Mycobacterium tuberculosis - compound 41c [3-hydroxy-5-(3-nitrophenoxy)benzoic acid] Descriptor: 3-dehydroquinate dehydratase, 3-hydroxy-5-(3-nitrophenoxy)benzoic acid Authors: Dias, M.V.B, Howard, N.G, Blundell, T.L, Abell, C. Deposit date: 2013-05-01 Release date: 2014-05-14 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis. Chemmedchem, 10, 2015
4Y7W	Yeast 20S proteasome in complex with Ac-LAE-ep Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Ac-LAE-ep, CHLORIDE ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-16 Release date: 2015-06-17 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015
5UGY	Influenza hemagglutinin in complex with a neutralizing antibody Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CH65 heavy chain, ... Authors: Whittle, J.R.R, Jenni, S, Harrison, S.C. Deposit date: 2017-01-10 Release date: 2017-01-25 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.801 Å) Cite: Broadly neutralizing human antibody that recognizes the receptor-binding pocket of influenza virus hemagglutinin. Proc. Natl. Acad. Sci. U.S.A., 108, 2011
4Y8J	Yeast 20S proteasome in complex with Ac-LLL-ep Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Ac-PLL-ep, CHLORIDE ION, ... Authors: Huber, E.M, Groll, M. Deposit date: 2015-02-16 Release date: 2015-06-17 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Systematic Analyses of Substrate Preferences of 20S Proteasomes Using Peptidic Epoxyketone Inhibitors. J.Am.Chem.Soc., 137, 2015

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