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7PRM	CRYSTAL STRUCTURE OF HUMAN MONOGLYCERIDE LIPASE WITH COMPOUND 13 Descriptor: (4~{R})-1-[4-(4-fluorophenyl)phenyl]-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]pyrrolidin-2-one, 1,2-ETHANEDIOL, Monoglyceride lipase Authors: Grether, U, Gobbi, L, Kuhn, B, Collin, L, Leibrock, L, Heer, D, Wittwer, M, Benz, J. Deposit date: 2021-09-22 Release date: 2022-02-16 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Development of High Brain-Penetrant and Reversible Monoacylglycerol Lipase PET Tracers for Neuroimaging. J.Med.Chem., 65, 2022
8IJO	Structure of DNA binding domain of McrBC endonuclease bound to DNA: Y41F-L68F double mutant Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*GP*AP*GP*AP*CP*CP*GP*GP*TP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*AP*CP*CP*GP*GP*TP*CP*TP*C)-3'), ... Authors: Adhav, V.A, Saikrishnan, K. Deposit date: 2023-02-27 Release date: 2024-02-28 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Structural basis of target recognition by the DNA binding domain of McrBC To Be Published
8IK4	Structure of DNA binding domain of McrBC endonuclease bound to hemimethylated DNA: L68F mutant Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*AP*GP*AP*(5CM)P*CP*GP*GP*TP*AP*G)-3'), DNA (5'-D(*CP*TP*AP*CP*CP*GP*GP*TP*CP*T)-3'), ... Authors: Adhav, V.A, Saikrishnan, K. Deposit date: 2023-02-28 Release date: 2024-02-28 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structural basis of target recognition by the DNA binding domain of McrBC To Be Published
8IJP	Structure of DNA binding domain of McrBC endonuclease bound to DNA: L68Y mutant Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*GP*AP*GP*AP*CP*CP*GP*GP*TP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*AP*CP*CP*GP*GP*TP*CP*TP*C)-3'), ... Authors: Adhav, V.A, Saikrishnan, K. Deposit date: 2023-02-27 Release date: 2024-02-28 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Structural basis of target recognition by the DNA binding domain of McrBC To Be Published
8IK8	Structure of DNA binding domain of McrBC endonuclease bound to DNA: L68F mutant Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*GP*AP*GP*AP*CP*CP*GP*GP*TP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*AP*CP*CP*GP*GP*TP*CP*TP*C)-3'), ... Authors: Adhav, V.A, Saikrishnan, K. Deposit date: 2023-02-28 Release date: 2024-02-28 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Structural basis of target recognition by the DNA binding domain of McrBC To Be Published
8IKD	Structure of DNA binding domain of McrBC endonuclease bound to DNA: Y41F-L68Y double mutant Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*GP*AP*GP*AP*CP*CP*GP*GP*TP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*AP*CP*CP*GP*GP*TP*CP*TP*C)-3'), ... Authors: Adhav, V.A, Saikrishnan, K. Deposit date: 2023-02-28 Release date: 2024-02-28 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structural basis of target recognition by the DNA binding domain of McrBC To Be Published
8ILT	Crystal structure of Est30 Descriptor: Carboxylesterase Authors: Feng, Y, Luo, Z. Deposit date: 2023-03-04 Release date: 2024-03-06 Method: X-RAY DIFFRACTION (2.42 Å) Cite: Crystal structure of Est30 To Be Published
2DJH	Crystal structure of the carboxy-terminal ribonuclease domain of Colicin E5 Descriptor: 2'-DEOXYURIDINE 3'-MONOPHOSPHATE, 2-AMINO-9-(2-DEOXY-3-O-PHOSPHONOPENTOFURANOSYL)-1,9-DIHYDRO-6H-PURIN-6-ONE, Colicin-E5 Authors: Yajima, S, Inoue, S, Ogawa, T, Nonaka, T, Ohsawa, K, Masaki, H. Deposit date: 2006-04-03 Release date: 2007-01-23 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Structural basis for sequence-dependent recognition of colicin E5 tRNase by mimicking the mRNA-tRNA interaction Nucleic Acids Res., 34, 2006
2ED6	Crystal Structure of Envelope Protein VP28 from White Spot Syndrome Virus (WSSV) Descriptor: 25kDa structural protein VP25 Authors: Hew, C.L, Sivaraman, J, Tang, X.H. Deposit date: 2007-02-14 Release date: 2007-06-05 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (2 Å) Cite: Crystal structures of major envelope proteins VP26 and VP28 from white spot syndrome virus shed light on their evolutionary relationship J.Virol., 81, 2007
2EQP	Solution structure of the stn_TNFRSF12A_TNFR domain of Tumor necrosis factor receptor superfamily member 12A precursor Descriptor: Tumor necrosis factor receptor superfamily member 12A Authors: Dang, W, Muto, Y, Inoue, M, Kigawa, T, Shirouzu, M, Terada, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) Deposit date: 2007-03-30 Release date: 2008-04-01 Last modified: 2024-05-29 Method: SOLUTION NMR Cite: Solution structure of the stn_TNFRSF12A_TNFR domain of Tumor necrosis factor receptor superfamily member 12A precursor To be Published
2FCG	Solution structure of the C-terminal fragment of human LL-37 Descriptor: Antibacterial protein FALL-39, core peptide Authors: Wang, G, Li, X. Deposit date: 2005-12-12 Release date: 2006-05-23 Last modified: 2024-05-29 Method: SOLUTION NMR Cite: Solution Structures of Human LL-37 Fragments and NMR-Based Identification of a Minimal Membrane-Targeting Antimicrobial and Anticancer Region. J.Am.Chem.Soc., 128, 2006
8PTQ	COMPLEX CRYSTAL STRUCTURE OF MUTANT HUMAN MONOGLYCERIDE LIPASE WITH COMPOUND 5l Descriptor: 1,2-ETHANEDIOL, Monoglyceride lipase, methyl 4-[(2~{S},3~{R})-3-(4-fluorophenyl)-1-(1-methanoylpiperidin-4-yl)-4-oxidanylidene-azetidin-2-yl]benzoate Authors: Butini, S, Grether, U, Benz, J, Leibrock, L, Maramai, S, Papa, A, Carullo, G, Federico, S, Grillo, A, Di Guglielmo, B, Lamponi, S, Gemma, S, Campiani, G. Deposit date: 2023-07-14 Release date: 2024-01-31 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Development of Potent and Selective Monoacylglycerol Lipase Inhibitors. SARs, Structural Analysis, and Biological Characterization. J.Med.Chem., 67, 2024
8PTC	COMPLEX CRYSTAL STRUCTURE OF MUTANT HUMAN MONOGLYCERIDE LIPASE WITH COMPOUND 5d Descriptor: 1,2-ETHANEDIOL, 4-[(3~{R},4~{S})-2-oxidanylidene-3,4-diphenyl-azetidin-1-yl]piperidine-1-carbaldehyde, Monoglyceride lipase Authors: Butini, S, Benz, J, Grether, U, Leibrock, L, Papa, A, Maramai, S, Carullo, G, Federico, S, Grillo, A, Di Guglielmo, B, Lamponi, S, Gemma, S, Campiani, G. Deposit date: 2023-07-14 Release date: 2024-01-31 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.51 Å) Cite: Development of Potent and Selective Monoacylglycerol Lipase Inhibitors. SARs, Structural Analysis, and Biological Characterization. J.Med.Chem., 67, 2024
8PTR	COMPLEX CRYSTAL STRUCTURE OF MUTANT HUMAN MONOGLYCERIDE LIPASE WITH COMPOUND 5r Descriptor: (3~{R},4~{S})-4-(1,3-benzodioxol-5-yl)-1-[1-(benzotriazol-1-ylcarbonyl)piperidin-4-yl]-3-(3-fluorophenyl)azetidin-2-one, 1,2-ETHANEDIOL, Monoglyceride lipase Authors: Butini, S, Benz, J, Grether, U, Leibrock, L, Papa, A, Maramai, S, Carullo, G, Federico, S, Grillo, A, Di Guglielmo, B, Lamponi, S, Gemma, S, Campiani, G. Deposit date: 2023-07-14 Release date: 2024-01-31 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.73 Å) Cite: Development of Potent and Selective Monoacylglycerol Lipase Inhibitors. SARs, Structural Analysis, and Biological Characterization. J.Med.Chem., 67, 2024
2FBS	Solution structure of the LL-37 core peptide bound to detergent micelles Descriptor: Antibacterial protein FALL-39, core peptide Authors: Wang, G, Li, X. Deposit date: 2005-12-10 Release date: 2006-05-23 Last modified: 2022-03-09 Method: SOLUTION NMR Cite: Solution Structures of Human LL-37 Fragments and NMR-Based Identification of a Minimal Membrane-Targeting Antimicrobial and Anticancer Region J.Am.Chem.Soc., 128, 2006
2FBU	Solution structure of the N-terminal fragment of human LL-37 Descriptor: Antibacterial protein FALL-39, core peptide Authors: Wang, G, Li, X. Deposit date: 2005-12-10 Release date: 2006-05-23 Last modified: 2024-05-29 Method: SOLUTION NMR Cite: Solution Structures of Human LL-37 Fragments and NMR-Based Identification of a Minimal Membrane-Targeting Antimicrobial and Anticancer Region J.Am.Chem.Soc., 128, 2006
2GOM	Crystal structure of Efb-C from Staphylococcus aureus Descriptor: Fibrinogen-binding protein Authors: Hammel, M, Geisbrecht, B.V. Deposit date: 2006-04-13 Release date: 2007-03-20 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (1.25 Å) Cite: A structural basis for complement inhibition by Staphylococcus aureus. Nat.Immunol., 8, 2007
2EDM	Crystal Structure of Envelope Protein VP26 from White Spot Syndrome Virus (WSSV) Descriptor: 22kDa structural protein VP22 Authors: Hew, C.L, Tang, X.H, Sivaraman, J. Deposit date: 2007-02-14 Release date: 2007-06-05 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal Structures of Major Envelope Proteins VP26 and VP28 from White Spot Syndrome Virus Shed Light on Their Evolutionary Relationship J.Virol., 81, 2007
4ILJ	Crystal structure of an Prp8p RNaseH W1911A mutant protein Descriptor: Pre-mRNA-splicing factor 8 Authors: Weber, G, Heroven, C, Santos, K.F, Wahl, M.C. Deposit date: 2012-12-31 Release date: 2013-03-13 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (2.0001 Å) Cite: Structural basis for dual roles of Aar2p in U5 snRNP assembly. Genes Dev., 27, 2013
5ZUN	Crystal structure of human monoacylglycerol lipase in complex with compound 3l Descriptor: (4R)-1-(2'-chloro[1,1'-biphenyl]-3-yl)-4-[4-(1,3-thiazole-2-carbonyl)piperazin-1-yl]pyrrolidin-2-one, 1,2-ETHANEDIOL, CHLORIDE ION, ... Authors: Sogabe, S, Zama, Y, Lane, W, Snell, G. Deposit date: 2018-05-08 Release date: 2018-10-17 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (1.35 Å) Cite: Design, Synthesis, and Evaluation of Piperazinyl Pyrrolidin-2-ones as a Novel Series of Reversible Monoacylglycerol Lipase Inhibitors J. Med. Chem., 61, 2018
4JK7	Open and closed forms of wild-type human PRP8 RNase H-like domain with bound Mg ion Descriptor: CHLORIDE ION, GLYCEROL, MAGNESIUM ION, ... Authors: Schellenberg, M.J, Wu, T, Ritchie, D.B, Atta, K, MacMillan, A.M. Deposit date: 2013-03-09 Release date: 2013-05-22 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.4 Å) Cite: A conformational switch in PRP8 mediates metal ion coordination that promotes pre-mRNA exon ligation. Nat.Struct.Mol.Biol., 20, 2013
4JKD	Open and closed forms of I1790Y human PRP8 RNase H-like domain with bound Mg ion Descriptor: CHLORIDE ION, MAGNESIUM ION, Pre-mRNA-processing-splicing factor 8 Authors: Schellenberg, M.J, Wu, T, Ritchie, D.B, Atta, K.A, MacMillan, A.M. Deposit date: 2013-03-09 Release date: 2013-05-22 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.55 Å) Cite: A conformational switch in PRP8 mediates metal ion coordination that promotes pre-mRNA exon ligation. Nat.Struct.Mol.Biol., 20, 2013
4KE8	Crystal structure of Monoglyceride lipase from Bacillus sp. H257 in complex with monopalmitoyl glycerol analogue Descriptor: Thermostable monoacylglycerol lipase, tetradecyl hydrogen (R)-(3-azidopropyl)phosphonate Authors: Rengachari, S, Aschauer, P, Gruber, K, Dreveny, I, Oberer, M. Deposit date: 2013-04-25 Release date: 2013-09-18 Last modified: 2019-07-17 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Conformational plasticity and ligand binding of bacterial monoacylglycerol lipase. J.Biol.Chem., 288, 2013
4KE6	Crystal structure D196N mutant of Monoglyceride lipase from Bacillus sp. H257 in complex with 1-rac-lauroyl glycerol Descriptor: (2R)-2,3-dihydroxypropyl dodecanoate, (4S)-2-METHYL-2,4-PENTANEDIOL, Thermostable monoacylglycerol lipase Authors: Rengachari, S, Aschauer, P, Gruber, K, Dreveny, I, Oberer, M. Deposit date: 2013-04-25 Release date: 2013-09-18 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Conformational plasticity and ligand binding of bacterial monoacylglycerol lipase. J.Biol.Chem., 288, 2013
4KE7	Crystal structure of Monoglyceride lipase from Bacillus sp. H257 in complex with an 1-myristoyl glycerol analogue Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Thermostable monoacylglycerol lipase, dodecyl hydrogen (S)-(3-azidopropyl)phosphonate Authors: Rengachari, S, Aschauer, P, Gruber, K, Dreveny, I, Oberer, M. Deposit date: 2013-04-25 Release date: 2013-09-18 Last modified: 2013-11-20 Method: X-RAY DIFFRACTION (1.699 Å) Cite: Conformational plasticity and ligand binding of bacterial monoacylglycerol lipase. J.Biol.Chem., 288, 2013

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