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1DM3	ACETYLATED BIOSYNTHETIC THIOLASE FROM ZOOGLOEA RAMIGERA IN COMPLEX WITH ACETYL-COA Descriptor: ACETYL COENZYME *A, BIOSYNTHETIC THIOLASE ACETYLATED AT CYS89, SULFATE ION Authors: Modis, Y, Wierenga, R.K. Deposit date: 1999-12-13 Release date: 2001-08-29 Last modified: 2017-10-04 Method: X-RAY DIFFRACTION (2 Å) Cite: Crystallographic analysis of the reaction pathway of Zoogloea ramigera biosynthetic thiolase. J.Mol.Biol., 297, 2000
4JXS	X-ray crystal structure of AmpC beta-lactamase from E. coli in complex with a non-covalent inhibitor 3-[(4-CARBOXYBENZYL)SULFAMOYL]THIOPHENE-2-CARBOXYLIC ACID (compound 4) Descriptor: 3-[(4-carboxybenzyl)sulfamoyl]thiophene-2-carboxylic acid, Beta-lactamase, PHOSPHATE ION Authors: Powers, R.A, Hendershot, J.M. Deposit date: 2013-03-28 Release date: 2014-05-07 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Structure-based efforts to optimize a non-beta-lactam inhibitor of AmpC beta-lactamase. Bioorg.Med.Chem., 22, 2014
3QCS	Phosphoinositide-Dependent Kinase-1 (PDK1) kinase domain with 6-[2-Amino-6-(4-morpholinyl)-4-pyrimidinyl]-1H-indazol-3-amine Descriptor: 3-phosphoinositide-dependent protein kinase 1, 6-[2-amino-6-(morpholin-4-yl)pyrimidin-4-yl]-2H-indazol-3-amine, GLYCEROL, ... Authors: Medina, J.R, Becker, C.J, Blackledge, C.W, Duquenne, C, Feng, Y, Grant, S.W, Heerding, D, Li, W.H, Miller, W.H, Romeril, S.P, Scherzer, D, Shu, A, Bobko, M.A, Chadderton, A.R, Dumble, M, Gradiner, C.M, Gilbert, S, Liu, Q, Rabindran, S.K, Sudakin, V, Xiang, H, Brady, P.G, Campobasso, N, Ward, P, Axten, J.M. Deposit date: 2011-01-17 Release date: 2011-03-09 Last modified: 2017-11-08 Method: X-RAY DIFFRACTION (2.487 Å) Cite: Structure-Based Design of Potent and Selective 3-Phosphoinositide-Dependent Kinase-1 (PDK1) Inhibitors. J.Med.Chem., 54, 2011
1DJX	PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C-DELTA1 FROM RAT COMPLEXED WITH INOSITOL-1,4,5-TRISPHOSPHATE Descriptor: ACETATE ION, CALCIUM ION, D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE, ... Authors: Essen, L.-O, Perisic, O, Williams, R.L. Deposit date: 1996-08-24 Release date: 1997-07-07 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Structural mapping of the catalytic mechanism for a mammalian phosphoinositide-specific phospholipase C. Biochemistry, 36, 1997
174L	PROTEIN FLEXIBILITY AND ADAPTABILITY SEEN IN 25 CRYSTAL FORMS OF T4 LYSOZYME Descriptor: SULFATE ION, T4 LYSOZYME Authors: Zhang, X.-J, Matthews, B.W. Deposit date: 1995-03-24 Release date: 1995-07-10 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Protein flexibility and adaptability seen in 25 crystal forms of T4 lysozyme. J.Mol.Biol., 250, 1995
1ALX	GRAMICIDIN D FROM BACILLUS BREVIS (METHANOL SOLVATE) Descriptor: GRAMICIDIN A, METHANOL Authors: Burkhart, B.M, Langs, D.A, Smith, G.D, Courseille, C, Precigoux, G, Hospital, M, Pangborn, W.A, Duax, W.L. Deposit date: 1997-06-05 Release date: 1998-03-04 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Heterodimer Formation and Crystal Nucleation of Gramicidin D Biophys.J., 75, 1998
171L	PROTEIN FLEXIBILITY AND ADAPTABILITY SEEN IN 25 CRYSTAL FORMS OF T4 LYSOZYME Descriptor: T4 LYSOZYME Authors: Heinz, D, Matthews, B.W. Deposit date: 1995-03-24 Release date: 1995-07-10 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Protein flexibility and adaptability seen in 25 crystal forms of T4 lysozyme. J.Mol.Biol., 250, 1995
1ALZ	GRAMICIDIN D FROM BACILLUS BREVIS (ETHANOL SOLVATE) Descriptor: ETHANOL, ILE-GRAMICIDIN C, VAL-GRAMICIDIN A Authors: Burkhart, B.M, Pangborn, W.A, Duax, W.L, Langs, D.A. Deposit date: 1997-06-06 Release date: 1998-03-04 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (0.86 Å) Cite: Heterodimer Formation and Crystal Nucleation of Gramicidin D Biophys.J., 75, 1998
167L	PROTEIN FLEXIBILITY AND ADAPTABILITY SEEN IN 25 CRYSTAL FORMS OF T4 LYSOZYME Descriptor: T4 LYSOZYME Authors: Weaver, L.H, Zhang, X.-J, Matthews, B.W. Deposit date: 1995-03-24 Release date: 1995-07-10 Last modified: 2017-11-29 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Protein flexibility and adaptability seen in 25 crystal forms of T4 lysozyme. J.Mol.Biol., 250, 1995
180L	PROTEIN FLEXIBILITY AND ADAPTABILITY SEEN IN 25 CRYSTAL FORMS OF T4 LYSOZYME Descriptor: LYSOZYME Authors: Kuroki, R, Weaver, L, Zhang, X.-J, Matthews, B.W. Deposit date: 1995-03-24 Release date: 1996-04-03 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Protein flexibility and adaptability seen in 25 crystal forms of T4 lysozyme. J.Mol.Biol., 250, 1995
4J8P	Crystal structure of a Putative flavoprotein (BACUNI_04544) from Bacteroides uniformis ATCC 8492 at 1.50 A resolution Descriptor: CHLORIDE ION, FLAVIN MONONUCLEOTIDE, Flavodoxin, ... Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2013-02-14 Release date: 2013-03-13 Last modified: 2023-02-01 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Crystal structure of a Putative flavoprotein (BACUNI_04544) from Bacteroides uniformis ATCC 8492 at 1.50 A resolution To be published
5T74	Human carboanhydrase F131C_C206S double mutant in complex with 14 Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-~{N}-(4-sulfamoylphenyl)ethanamide, 4-(HYDROXYMERCURY)BENZOIC ACID, ... Authors: DuBay, K.H, Iwan, K, Osorio-Planes, L, Geissler, P, Groll, M, Trauner, D, Broichhagen, J. Deposit date: 2016-09-02 Release date: 2017-09-06 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.2 Å) Cite: A Predictive Approach for the Optical Control of Carbonic Anhydrase II Activity. ACS Chem. Biol., 13, 2018
5VLO	The structure of human CamKII with bound inhibitor Descriptor: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, Calcium/calmodulin-dependent protein kinase type II subunit delta, N-[(2S)-2-(diethylamino)propyl]-2-[(2S)-2-(methylcarbamoyl)azetidin-1-yl]-6-[5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]pyridine-4-carboxamide Authors: Somoza, J.R, Villasenor, A.G. Deposit date: 2017-04-25 Release date: 2017-08-23 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (2.05 Å) Cite: Inhibitors of CamKII To Be Published
1DO3	CARBONMONOXY-MYOGLOBIN (MUTANT L29W) AFTER PHOTOLYSIS AT T>180K Descriptor: CARBON MONOXIDE, MYOGLOBIN, PROTOPORPHYRIN IX CONTAINING FE, ... Authors: Ostermann, A, Waschipky, R, Parak, F.G, Nienhaus, G.U. Deposit date: 1999-12-18 Release date: 2000-01-05 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Ligand binding and conformational motions in myoglobin. Nature, 404, 2000
5W1B	Tryptophan indole-lyase Descriptor: POTASSIUM ION, Tryptophanase Authors: Phillips, R.S, Wood, Z.A. Deposit date: 2017-06-02 Release date: 2018-06-06 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (2 Å) Cite: The crystal structure of Proteus vulgaris tryptophan indole-lyase complexed with oxindolyl-L-alanine: implications for the reaction mechanism. Acta Crystallogr D Struct Biol, 74, 2018
1B2X	BARNASE WILDTYPE STRUCTURE AT PH 7.5 FROM A CRYO_COOLED CRYSTAL AT 100K Descriptor: PROTEIN (BARNASE), ZINC ION Authors: Harrison, P, Vaughan, C.K, Buckle, A.M, Fersht, A.R. Deposit date: 1998-12-03 Release date: 1998-12-09 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.8 Å) Cite: A structural double-mutant cycle: estimating the strength of a buried salt bridge in barnase. Acta Crystallogr.,Sect.D, 58, 2002
1B4P	CRYSTAL STRUCTURES OF CLASS MU CHIMERIC GST ISOENZYMES M1-2 AND M2-1 Descriptor: L-gamma-glutamyl-S-[(9S,10S)-10-hydroxy-9,10-dihydrophenanthren-9-yl]-L-cysteinylglycine, PROTEIN (GLUTATHIONE S-TRANSFERASE), SULFATE ION Authors: Xiao, G, Chen, J, Armstrong, R.N, Gilliland, G.L. Deposit date: 1998-12-26 Release date: 2003-07-08 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal Structures of Class MU Chimeric GST Isoenzymes M1-2 and M2-1 To be Published
1B2U	STRUCTURAL RESPONSE TO MUTATION AT A PROTEIN-PROTEIN INTERFACE Descriptor: PROTEIN (BARNASE), PROTEIN (BARSTAR) Authors: Vaughan, C.K, Buckle, A.M, Fersht, A.R. Deposit date: 1998-12-01 Release date: 1998-12-09 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structural response to mutation at a protein-protein interface. J.Mol.Biol., 286, 1999
1AR9	P1/MAHONEY POLIOVIRUS, SINGLE SITE MUTANT H2142Y Descriptor: MYRISTIC ACID, P1/MAHONEY POLIOVIRUS, SPHINGOSINE Authors: Wien, M.W, Curry, S, Filman, D.J, Hogle, J.M. Deposit date: 1997-08-11 Release date: 1997-12-03 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Structural studies of poliovirus mutants that overcome receptor defects. Nat.Struct.Biol., 4, 1997
3SI0	Structure of glycosylated human glutaminyl cyclase Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, Glutaminyl-peptide cyclotransferase, ... Authors: Parthier, C, Carrillo, D, Stubbs, M.T. Deposit date: 2011-06-17 Release date: 2011-06-29 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structures of Glycosylated Mammalian Glutaminyl Cyclases Reveal Conformational Variability near the Active Center. Biochemistry, 50, 2011
1AU9	SUBTILISIN BPN' MUTANT 8324 IN CITRATE Descriptor: CALCIUM ION, ISOPROPYL ALCOHOL, SUBTILISIN BPN', ... Authors: Whitlow, M, Howard, A.J, Wood, J.F. Deposit date: 1997-09-12 Release date: 1997-12-31 Last modified: 2021-11-03 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Large increases in general stability for subtilisin BPN' through incremental changes in the free energy of unfolding. Biochemistry, 28, 1989
4JXW	X-ray crystal structure of AmpC beta-lactamase from E. coli in complex with a non-covalent inhibitor 3-{[3-(4-CARBOXYPHENYL)PROPYL]SULFAMOYL}THIOPHENE-2-CARBOXYLIC ACID (compound 6) Descriptor: 3-{[3-(4-carboxyphenyl)propyl]sulfamoyl}thiophene-2-carboxylic acid, Beta-lactamase, PHOSPHATE ION Authors: Powers, R.A, Hendershot, J.M. Deposit date: 2013-03-28 Release date: 2014-05-07 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Structure-based efforts to optimize a non-beta-lactam inhibitor of AmpC beta-lactamase. Bioorg.Med.Chem., 22, 2014
1DLV	BIOSYNTHETIC THIOLASE FROM ZOOGLOEA RAMIGERA IN COMPLEX WITH COA Descriptor: BIOSYNTHETIC THIOLASE, COENZYME A, SULFATE ION Authors: Modis, Y, Wierenga, R.K. Deposit date: 1999-12-12 Release date: 2000-04-24 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.29 Å) Cite: Crystallographic analysis of the reaction pathway of Zoogloea ramigera biosynthetic thiolase. J.Mol.Biol., 297, 2000
1DO7	CARBONMONOXY-MYOGLOBIN (MUTANT L29W) REBINDING STRUCTURE AFTER PHOTOLYSIS AT T< 180K Descriptor: CARBON MONOXIDE, MYOGLOBIN, PROTOPORPHYRIN IX CONTAINING FE, ... Authors: Ostermann, A, Waschipky, R, Parak, F.G, Nienhaus, G.U. Deposit date: 1999-12-19 Release date: 2000-01-05 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Ligand binding and conformational motions in myoglobin. Nature, 404, 2000
3U0K	Crystal Structure of the genetically encoded calcium indicator RCaMP Descriptor: ACETATE ION, CALCIUM ION, RCaMP Authors: Akerboom, J, Looger, L.L, Schreiter, E.R. Deposit date: 2011-09-28 Release date: 2012-10-03 Last modified: 2024-07-10 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Genetically encoded calcium indicators for multi-color neural activity imaging and combination with optogenetics. Front Mol Neurosci, 6, 2013

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