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1U9F	Heterocyclic Peptide Backbone Modification in GCN4-pLI Based Coiled Coils: Replacement of K(15)L(16) Descriptor: General control protein GCN4 Authors: Horne, W.S, Yadav, M.K, Stout, C.D, Ghadiri, M.R. Deposit date: 2004-08-09 Release date: 2004-11-30 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Heterocyclic peptide backbone modifications in an alpha-helical coiled coil. J.Am.Chem.Soc., 126, 2004
3AGX	Crystal structure of human Hsp40 Hdj1 peptide-binding domain Descriptor: DnaJ homolog subfamily B member 1 Authors: Suzuki, H, Noguchi, S, Satow, Y. Deposit date: 2010-04-12 Release date: 2011-02-23 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Peptide-binding sites as revealed by the crystal structures of the human Hsp40 Hdj1 C-terminal domain in complex with the octapeptide from human Hsp70 Biochemistry, 49, 2010
2ZYE	Structure of HIV-1 Protease in Complex with Potent Inhibitor KNI-272 Determined by Neutron Crystallography Descriptor: (4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-({N-[(isoquinolin-5-yloxy)acetyl]-S-methyl-L-cysteinyl}amino)-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide, protease Authors: Adachi, M, Ohhara, T, Tamada, T, Okazaki, N, Kuroki, R. Deposit date: 2009-01-20 Release date: 2009-03-24 Last modified: 2024-05-29 Method: NEUTRON DIFFRACTION (1.9 Å) Cite: Structure of HIV-1 protease in complex with potent inhibitor KNI-272 determined by high-resolution X-ray and neutron crystallography. Proc.Natl.Acad.Sci.USA, 2009
3A7F	Human MST3 kinase Descriptor: Serine/threonine kinase 24 (STE20 homolog, yeast) Authors: Ko, T.P, Jeng, W.Y, Liu, C.I, Lai, M.D, Wang, A.H.J. Deposit date: 2009-09-26 Release date: 2010-02-02 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Structures of human MST3 kinase in complex with adenine, ADP and Mn2+. Acta Crystallogr.,Sect.D, 66, 2010
1UFW	Solution structure of RNP domain in Synaptojanin 2 Descriptor: Synaptojanin 2 Authors: He, F, Muto, Y, Ushikoshi, R, Shirouzu, M, Terada, T, Kigawa, T, Inoue, M, Yabuki, T, Aoki, M, Seki, E, Matsuda, T, Hirota, H, Yoshida, M, Kobayashi, N, Tanaka, A, Osanai, T, Matsuo, Y, Ohara, O, Nagase, T, Kikuno, R, Nakayama, M, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) Deposit date: 2003-06-10 Release date: 2003-12-10 Last modified: 2023-12-27 Method: SOLUTION NMR Cite: Solution structure of RNP domain in Synaptojanin 2 To be Published
1U3T	Crystal Structure of Human Alcohol Dehydrogenase Alpha-Alpha Isoform Complexed with N-Cyclopentyl-N-Cyclobutylformamide Determined to 2.5 Angstrom Resolution Descriptor: Alcohol dehydrogenase alpha chain, CYCLOBUTYL(CYCLOPENTYL)FORMAMIDE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... Authors: Gibbons, B.J, Hurley, T.D. Deposit date: 2004-07-23 Release date: 2004-10-26 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (2.49 Å) Cite: Structure of three class I human alcohol dehydrogenases complexed with isoenzyme specific formamide inhibitors Biochemistry, 43, 2004
3AO2	Fragment-based approach to the design of ligands targeting a novel site on HIV-1 integrase Descriptor: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 3-(7-bromo-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-5-amine, ... Authors: Wielens, J, Chalmers, D.K, Headey, S.J, Parker, M.W, Scanlon, M.J. Deposit date: 2010-09-20 Release date: 2011-03-16 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Fragment-based design of ligands targeting a novel site on the integrase enzyme of human immunodeficiency virus 1 Chemmedchem, 6, 2011
385D	FORMATION OF A NEW COMPOUND IN THE CRYSTAL STRUCTURE OF CYANOMORPHOLINODOXORUBICIN COMPLEXED WITH D(CGATCG) Descriptor: DNA (5'-D(*CP*GP*AP*TP*CP*G)-3'), N-ETHYLHYDROXY-DOXORUBICIN Authors: Ettorre, A, Cirilli, M, Ughetto, G. Deposit date: 1998-03-05 Release date: 1998-10-30 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Degradation of the morpholino ring in the crystal structure of cyanomorpholinodoxorubicin complexed with d(CGATCG). Eur.J.Biochem., 258, 1998
1TVC	FAD and NADH binding domain of methane monooxygenase reductase from Methylococcus capsulatus (Bath) Descriptor: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, METHANE MONOOXYGENASE COMPONENT C Authors: Chatwood, L.L, Mueller, J, Gross, J.D, Wagner, G, Lippard, S.J. Deposit date: 2004-06-29 Release date: 2004-10-12 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: NMR Structure of the Flavin Domain from Soluble Methane Monooxygenase Reductase from Methylococcus capsulatus (Bath) Biochemistry, 43, 2004
397D	A 1.3 A RESOLUTION CRYSTAL STRUCTURE OF THE HIV-1 TRANS-ACTIVATION RESPONSE REGION RNA STEM REVEALS A METAL ION-DEPENDENT BULGE CONFORMATION Descriptor: CALCIUM ION, RNA (5'-R(*GP*CP*UP*CP*UP*CP*UP*GP*GP*CP*CP*C)-3'), RNA (5'-R(*GP*GP*CP*CP*AP*GP*AP*UP*CP*UP*GP*AP*GP*CP*G)-3') Authors: Ippolito, J.A, Steitz, T.A. Deposit date: 1998-04-30 Release date: 1998-09-11 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.3 Å) Cite: A 1.3-A resolution crystal structure of the HIV-1 trans-activation response region RNA stem reveals a metal ion-dependent bulge conformation. Proc.Natl.Acad.Sci.USA, 95, 1998
1UC9	Crystal structure of a lysine biosynthesis enzyme, Lysx, from thermus thermophilus HB8 Descriptor: ADENOSINE-5'-DIPHOSPHATE, lysine biosynthesis enzyme Authors: Sakai, H, Vassylyeva, M.N, Matsuura, T, Sekine, S, Nishiyama, M, Terada, T, Shirouzu, M, Kuramitsu, S, Vassylyev, D.G, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) Deposit date: 2003-04-09 Release date: 2003-09-23 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.38 Å) Cite: Crystal Structure of a Lysine Biosynthesis Enzyme, LysX, from Thermus thermophilus HB8 J.Mol.Biol., 332, 2003
1TQ7	Crystal structure of the anticoagulant thrombin mutant W215A/E217A bound to PPACK Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide, Prothrombin, ... Authors: Pineda, A.O, Chen, Z.-W, Caccia, S, Savvides, S.N, Waksman, G, Mathews, F.S, Di Cera, E. Deposit date: 2004-06-16 Release date: 2004-08-03 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (2.4 Å) Cite: The anticoagulant thrombin mutant W215A/E217A has a collapsed primary specificity pocket J.Biol.Chem., 279, 2004
1TSJ	Crystal structure of protein from Staphylococcus aureus Descriptor: conserved hypothetical protein Authors: Min, T, Gorman, J, Shapiro, L, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC) Deposit date: 2004-06-21 Release date: 2004-12-14 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (2.6 Å) Cite: The crystal structure of conserved hypothetical protein To be Published
362D	THE STRUCTURE OF D(TGCGCA)2 AND A COMPARISON TO OTHER Z-DNA HEXAMERS Descriptor: COBALT HEXAMMINE(III), DNA (5'-D(*TP*GP*CP*GP*CP*A)-3') Authors: Harper, N.A, Brannigan, J.A, Buck, M, Lewis, R.J, Moore, M.H, Schneider, B. Deposit date: 1997-08-20 Release date: 1997-11-20 Last modified: 2023-08-02 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Structure of d(TGCGCA)2 and a comparison to other DNA hexamers. Acta Crystallogr.,Sect.D, 54, 1998
3AEX	Catalytic intermediate analogue of threonine synthase from Thermus thermophilus HB8 Descriptor: (3E)-4-{3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}-2-oxobut-3-enoic acid, PHOSPHATE ION, Threonine synthase Authors: Murakawa, T, Machida, Y, Hayashi, H. Deposit date: 2010-02-13 Release date: 2010-11-17 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Product-assisted catalysis as the basis of the reaction specificity of threonine synthase. J.Biol.Chem., 286, 2011
1QWM	Structure of Helicobacter pylori catalase with formic acid bound Descriptor: AZIDE ION, FORMIC ACID, KatA catalase, ... Authors: Loewen, P.C, Carpena, X, Perez-Luque, R, Rovira, C, Haas, R, Odenbreit, S, Nicholls, P, Fita, I. Deposit date: 2003-09-02 Release date: 2004-03-30 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Structure of Helicobacter pylori Catalase, with and without Formic Acid Bound, at 1.6 A Resolution Biochemistry, 43, 2004
1UC8	Crystal structure of a lysine biosynthesis enzyme, Lysx, from thermus thermophilus HB8 Descriptor: lysine biosynthesis enzyme Authors: Sakai, H, Vassylyeva, M.N, Matsuura, T, Sekine, S, Nishiyama, M, Terada, T, Shirouzu, M, Kuramitsu, S, Vassylyev, D.G, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) Deposit date: 2003-04-09 Release date: 2003-09-23 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2 Å) Cite: Crystal Structure of a Lysine Biosynthesis Enzyme, LysX, from Thermus thermophilus HB8 J.Mol.Biol., 332, 2003
1R0B	Aspartate Transcarbamylase (ATCase) of Escherichia coli: A New Crystalline R State Bound to PALA, or to Product Analogues Phosphate and Citrate Descriptor: Aspartate carbamoyltransferase catalytic chain, Aspartate carbamoyltransferase regulatory chain, CITRATE ANION, ... Authors: Huang, J, Lipscomb, W.N. Deposit date: 2003-09-19 Release date: 2004-06-08 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Aspartate Transcarbamylase (ATCase) of Escherichia coli: A New Crystalline R-State Bound to PALA, or to Product Analogues Citrate and Phosphate Biochemistry, 43, 2004
1QZV	Crystal structure of plant photosystem I Descriptor: CHLOROPHYLL A, IRON/SULFUR CLUSTER, PHYLLOQUINONE, ... Authors: Ben-Shem, A, Frolow, F, Nelson, N. Deposit date: 2003-09-18 Release date: 2004-01-06 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (4.44 Å) Cite: Crystal structure of plant photosystem I. Nature, 426, 2003
3AAP	Crystal Structure of Lp1NTPDase from Legionella pneumophila Descriptor: Ectonucleoside triphosphate diphosphohydrolase I Authors: Vivian, J.P, Beddoe, T, Rossjohn, J. Deposit date: 2009-11-24 Release date: 2010-02-09 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Crystal Structure of a Legionella pneumophila Ecto -Triphosphate Diphosphohydrolase, A Structural and Functional Homolog of the Eukaryotic NTPDases Structure, 18, 2010
3ANA	THREE-DIMENSIONAL STRUCTURE OF D(GGGATCCC) IN THE CRYSTALLINE STATE Descriptor: DNA (5'-D(*GP*GP*GP*AP*TP*CP*CP*C)-3') Authors: Heinemann, U, Lauble, H. Deposit date: 1988-07-06 Release date: 1989-01-09 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Three-dimensional structure of d(GGGATCCC) in the crystalline state. Nucleic Acids Res., 16, 1988
1QMH	Crystal structure of RNA 3'-terminal phosphate cyclase, an ubiquitous enzyme with unusual topology Descriptor: 1-HYDROXYSULFANYL-4-MERCAPTO-BUTANE-2,3-DIOL, CITRIC ACID, RNA 3'-TERMINAL PHOSPHATE CYCLASE Authors: Palm, G.J, Billy, E, Filipowicz, W, Wlodawer, A. Deposit date: 1999-09-28 Release date: 2000-01-11 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Crystal Structure of RNA 3'-Terminal Phosphate Cyclase, a Ubiquitous Enzyme with Unusual Topology Structure, 8, 2000
1UCL	Mutants of RNase Sa Descriptor: Guanyl-specific ribonuclease Sa, SULFATE ION Authors: Takano, K, Scholtz, J.M, Sacchettini, J.C, Pace, C.N. Deposit date: 2003-04-15 Release date: 2003-09-09 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.82 Å) Cite: The contribution of polar group burial to protein stability is strongly context-dependent J.Biol.Chem., 278, 2003
3AO1	Fragment-based approach to the design of ligands targeting a novel site in HIV-1 integrase Descriptor: 1,3-benzodioxol-5-ol, CADMIUM ION, POL polyprotein, ... Authors: Wielens, J, Parker, M.W, Chalmers, D.K, Scanlon, M.J. Deposit date: 2010-09-17 Release date: 2011-03-09 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Fragment-based design of ligands targeting a novel site on the integrase enzyme of human immunodeficiency virus 1 Chemmedchem, 6, 2011
1QYC	Crystal structures of pinoresinol-lariciresinol and phenylcoumaran benzylic ether reductases, and their relationship to isoflavone reductases Descriptor: phenylcoumaran benzylic ether reductase PT1 Authors: Min, T, Kasahara, H, Bedgar, D.L, Youn, B, Lawrence, P.K, Gang, D.R, Halls, S.C, Park, H, Hilsenbeck, J.L, Davin, L.B, Kang, C. Deposit date: 2003-09-10 Release date: 2003-11-04 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Crystal structures of pinoresinol-lariciresinol and phenylcoumaran benzylic ether reductases and their relationship to isoflavone reductases. J.Biol.Chem., 278, 2003

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