PDB: 236060 resultsInfo pagesStatus searchChemie searchBIRD

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3MSL	Fragment Based Discovery and Optimisation of BACE-1 Inhibitors Descriptor: (3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-(cyclohexylmethyl)pentanamide, Beta-secretase 1, IODIDE ION Authors: Smith, M, Madden, J, Barker, J. Deposit date: 2010-04-29 Release date: 2010-07-14 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Fragment-based discovery and optimization of BACE1 inhibitors. Bioorg.Med.Chem.Lett., 20, 2010
3MSN	Crystal structure of Thermolysin in complex with N-methylurea Descriptor: CALCIUM ION, GLYCEROL, N-METHYLUREA, ... Authors: Behnen, J, Heine, A, Klebe, G. Deposit date: 2010-04-29 Release date: 2011-05-11 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.97 Å) Cite: Experimental and computational active site mapping as a starting point to fragment-based lead discovery. Chemmedchem, 7, 2012
3MSO	Crystal structure of a STEROID DELTA-ISOMERASE (NP_250810.1) from PSEUDOMONAS AERUGINOSA at 2.57 A resolution Descriptor: STEROID DELTA-ISOMERASE Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2010-04-29 Release date: 2010-06-09 Last modified: 2024-11-20 Method: X-RAY DIFFRACTION (2.57 Å) Cite: Crystal structure of a STEROID DELTA-ISOMERASE (PA2120) from PSEUDOMONAS AERUGINOSA at 2.57 A resolution To be published
3MSP	MOTILE MAJOR SPERM PROTEIN (MSP) OF ASCARIS SUUM, NMR, 20 STRUCTURES Descriptor: MAJOR SPERM PROTEIN Authors: Haaf, A, Leclaire III, L, Roberts, G, Kent, H.M, Roberts, T.M, Stewart, M, Neuhaus, D. Deposit date: 1998-09-10 Release date: 1999-04-20 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Solution structure of the motile major sperm protein (MSP) of Ascaris suum - evidence for two manganese binding sites and the possible role of divalent cations in filament formation. J.Mol.Biol., 284, 1998
3MSQ	Crystal structure of a Putative ubiquinone biosynthesis protein (Npun02000094) from Nostoc punctiforme PCC 73102 at 2.85 A resolution Descriptor: Putative ubiquinone biosynthesis protein Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2010-04-29 Release date: 2010-08-04 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (2.85 Å) Cite: Crystal structure of a Putative ubiquinone biosynthesis protein (Npun02000094) from Nostoc punctiforme PCC 73102 at 2.85 A resolution To be published
3MSR	The crystal structure of an amidohydrolase from Mycoplasma synoviae Descriptor: GLYCEROL, PHOSPHATE ION, amidohydrolases Authors: Zhang, Z, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) Deposit date: 2010-04-29 Release date: 2010-05-12 Last modified: 2024-11-27 Method: X-RAY DIFFRACTION (2.162 Å) Cite: The crystal structure of an amidohydrolase from Mycoplasma synoviae To be Published
3MSS	Abl kinase in complex with imatinib and fragment (FRAG2) in the myristate site Descriptor: 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE, O-benzyl-N-methyl-L-tyrosinamide, Tyrosine-protein kinase ABL1 Authors: Cowan-Jacob, S.W, Rummel, G, Fendrich, G. Deposit date: 2010-04-29 Release date: 2010-05-26 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Binding or bending: distinction of allosteric Abl kinase agonists from antagonists by an NMR-based conformational assay. J.Am.Chem.Soc., 132, 2010
3MST	Crystal structure of a Putative nitrate transport protein (TVN0104) from THERMOPLASMA VOLCANIUM at 1.35 A resolution Descriptor: 1,2-ETHANEDIOL, ACETATE ION, CHLORIDE ION, ... Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2010-04-29 Release date: 2011-02-09 Last modified: 2024-11-27 Method: X-RAY DIFFRACTION (1.35 Å) Cite: Crystal structure of a Putative nitrate transport protein (TVN0104) from THERMOPLASMA VOLCANIUM at 1.35 A resolution To be published
3MSU	Crystal Structure of Citrate Synthase from Francisella tularensis Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETIC ACID, CHLORIDE ION, ... Authors: Maltseva, N, Kim, Y, Hasseman, J, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) Deposit date: 2010-04-29 Release date: 2010-05-26 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.843 Å) Cite: Crystal Structure of Citrate Synthase from Francisella tularensis To be Published
3MSV	The hypoxic regulator of sterol synthesis Nro1 is a nuclear import adaptor Descriptor: Nuclear import adaptor, Nro1 Authors: Yeh, T.L, Amzel, L.M, Bianchet, M.A. Deposit date: 2010-04-29 Release date: 2011-04-20 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.18 Å) Cite: The hypoxic regulator of sterol synthesis nro1 is a nuclear import adaptor. Structure, 19, 2011
3MSW	Crystal structure of a Protein with unknown function (BF3112) from Bacteroides fragilis NCTC 9343 at 1.90 A resolution Descriptor: CHLORIDE ION, R-1,2-PROPANEDIOL, uncharacterized protein Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2010-04-29 Release date: 2010-06-09 Last modified: 2024-11-20 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Structures of single-layer beta-sheet proteins evolved from beta-hairpin repeats. Protein Sci., 28, 2019
3MSX	Crystal structure of RhoA.GDP.MgF3 in complex with GAP domain of ArhGAP20 Descriptor: GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Rho GTPase-activating protein 20, ... Authors: Utepbergenov, D, Cooper, D.R, Derewenda, U, Derewenda, Z.S. Deposit date: 2010-04-29 Release date: 2011-03-16 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Mechanism of molecular specificity of RhoGAP domains towards small GTPases of RhoA family. To be Published
3MSY	Crystal Structure of Mandelate racemase/muconate lactonizing enzyme from a Marine actinobacterium Descriptor: Mandelate racemase/muconate lactonizing enzyme Authors: Satyanarayana, L, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) Deposit date: 2010-04-29 Release date: 2010-06-30 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Crystal Structure of Mandelate racemase/muconate lactonizing enzyme from a Marine actinobacterium To be Published
3MSZ	Crystal Structure of Glutaredoxin 1 from Francisella tularensis Complexed with Cacodylate Descriptor: CACODYLATE ION, GLUTATHIONE, GLYCEROL, ... Authors: Maltseva, N, Kim, Y, Kwon, K, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) Deposit date: 2010-04-29 Release date: 2010-05-19 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.053 Å) Cite: Crystal Structure of Glutaredoxin 1 from Francisella tularensis Complexed with Cacodylate To be Published
3MT0	The crystal structure of a functionally unknown protein PA1789 from Pseudomonas aeruginosa PAO1 Descriptor: CHLORIDE ION, uncharacterized protein PA1789 Authors: Tan, K, Chang, C, Tesar, C, Bearden, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) Deposit date: 2010-04-29 Release date: 2010-05-12 Last modified: 2024-11-20 Method: X-RAY DIFFRACTION (1.582 Å) Cite: The crystal structure of a functionally unknown protein PA1789 from Pseudomonas aeruginosa PAO1 To be Published
3MT1	Crystal structure of putative carboxynorspermidine decarboxylase protein from Sinorhizobium meliloti Descriptor: Putative carboxynorspermidine decarboxylase protein, SULFATE ION Authors: Chang, C, Xu, X, Cui, H, Chin, S, Savchenko, A, Edwards, A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) Deposit date: 2010-04-29 Release date: 2010-06-30 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Crystal structure of putative carboxynorspermidine decarboxylase protein from Sinorhizobium meliloti To be Published
3MT5	Crystal Structure of the Human BK Gating Apparatus Descriptor: CALCIUM ION, Potassium large conductance calcium-activated channel, subfamily M, ... Authors: Yuan, P, MacKinnon, R. Deposit date: 2010-04-30 Release date: 2010-06-09 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (3 Å) Cite: Structure of the human BK channel Ca2+-activation apparatus at 3.0 A resolution. Science, 329, 2010
3MT6	Structure of ClpP from Escherichia coli in complex with ADEP1 Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, ACYLDEPSIPEPTIDE 1, ATP-dependent Clp protease proteolytic subunit Authors: Chung, Y.S. Deposit date: 2010-04-30 Release date: 2010-11-03 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (1.901 Å) Cite: Acyldepsipeptide antibiotics induce the formation of a structured axial channel in ClpP: A model for the ClpX/ClpA-bound state of ClpP. Chem.Biol., 17, 2010
3MT7	Glycogen phosphorylase complexed with 4-bromobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2E)-2-[(4-bromophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010
3MT8	Glycogen phosphorylase complexed with 4-chlorobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2E)-2-[(4-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010
3MT9	Glycogen phosphorylase complexed with 4-nitrobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2E)-2-[(4-nitrophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.05 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010
3MTA	Glycogen phosphorylase complexed with 3-bromobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2E)-2-[(3-bromophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.23 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010
3MTB	Glycogen phosphorylase complexed with 3-chlorobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2E)-2-[(3-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (1.95 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010
3MTC	Crystal Structure of INPP5B in complex with phosphatidylinositol 4-phosphate Descriptor: (2R)-3-{[(S)-hydroxy{[(1R,2R,3R,4R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propane-1,2-diyl dioctanoate, CHLORIDE ION, GLYCEROL, ... Authors: Tresaugues, L, Welin, M, Arrowsmith, C.H, Berglund, H, Bountra, C, Collins, R, Edwards, A.M, Flodin, S, Flores, A, Graslund, S, Hammarstrom, M, Johansson, I, Karlberg, T, Kol, S, Kotenyova, T, Moche, M, Nyman, T, Persson, C, Schuler, H, Schutz, P, Siponen, M.I, Thorsell, A.G, van der Berg, S, Wahlberg, E, Weigelt, J, Wisniewska, M, Nordlund, P, Structural Genomics Consortium (SGC) Deposit date: 2010-04-30 Release date: 2010-06-30 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Structural basis for phosphoinositide substrate recognition, catalysis, and membrane interactions in human inositol polyphosphate 5-phosphatases Structure, 22, 2014
3MTD	Glycogen phosphorylase complexed with 4-hydroxybenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone Descriptor: Glycogen phosphorylase, muscle form, N-({(2Z)-2-[(4-hydroxyphenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine Authors: Alexacou, K.-M. Deposit date: 2010-04-30 Release date: 2011-01-05 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.096 Å) Cite: The binding of beta-D-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: a new class of inhibitors Bioorg.Med.Chem., 18, 2010

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