PDB: 223790 resultsInfo pagesStatus searchChemie searchBIRD

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4DLT	H-Ras Set 2 Ca(OAc)2, on Descriptor: ACETATE ION, CALCIUM ION, GTPase HRas, ... Authors: Holzapfel, G, Mattos, C. Deposit date: 2012-02-06 Release date: 2012-08-08 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.699 Å) Cite: Shift in the Equilibrium between On and Off States of the Allosteric Switch in Ras-GppNHp Affected by Small Molecules and Bulk Solvent Composition. Biochemistry, 51, 2012
4FG3	Crystal Structure Analysis of the Human Insulin Descriptor: CHLORIDE ION, GLYCEROL, Insulin, ... Authors: Lima, L.M.T.R, Favero-Retto, M.P. Deposit date: 2012-06-02 Release date: 2013-06-12 Last modified: 2017-11-15 Method: X-RAY DIFFRACTION (2.001 Å) Cite: Structural meta-analysis of regular human insulin in pharmaceutical formulations. Eur J Pharm Biopharm, 85, 2013
3SW4	Crystal Structure of the CDK2 in complex with thiazolylpyrimidine inhibitor Descriptor: ACETATE ION, Cyclin-dependent kinase 2, N'-[4-(2-amino-4-methyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-N,N-dimethylbenzene-1,4-diamine Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2011-07-13 Release date: 2012-08-01 Last modified: 2017-11-08 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal Structure of the CDK2 in complex with a thiazolylpyrimidine inhibitor To be Published
3FSR	Chimera of alcohol dehydrogenase by exchange of the cofactor binding domain res 153-295 of T. brockii ADH by C. beijerinckii ADH Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, NADP-dependent alcohol dehydrogenase, ... Authors: Frolow, F, Greenblatt, H, Goihberg, E, Burstein, Y. Deposit date: 2009-01-11 Release date: 2010-01-19 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Biochemical and structural properties of chimeras constructed by exchange of cofactor-binding domains in alcohol dehydrogenases from thermophilic and mesophilic microorganisms Biochemistry, 49, 2010
3SX5	Crystal structure of AABB+UDP+Gal with MPD as the cryoprotectant Descriptor: DI(HYDROXYETHYL)ETHER, Histo-blood group ABO system transferase, MANGANESE (II) ION, ... Authors: Johal, A.R, Evans, S.V. Deposit date: 2011-07-14 Release date: 2012-02-29 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.43 Å) Cite: Sequence-dependent effects of cryoprotectants on the active sites of the human ABO(H) blood group A and B glycosyltransferases. Acta Crystallogr.,Sect.D, 68, 2012
2OZP	Crystal structure of N-acetyl-gamma-glutamyl-phosphate reductase (TTHA1904) from Thermus thermophilus Descriptor: AZIDE ION, N-acetyl-gamma-glutamyl-phosphate reductase, SULFATE ION Authors: Rehse, P.H, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) Deposit date: 2007-02-27 Release date: 2007-08-28 Last modified: 2017-10-25 Method: X-RAY DIFFRACTION (2.01 Å) Cite: Crystal structure of N-acetyl-gamma-glutamyl-phosphate reductase (TTHA1904) from Thermus thermophilus To be Published
4FOV	Crystal structure of the NanB sialidase from streptococcus pneumoniae in complex with 3-Cyclohexyl-1-propylsulfonic acid Descriptor: 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID, DIMETHYL SULFOXIDE, Sialidase B Authors: Brear, P. Deposit date: 2012-06-21 Release date: 2012-10-31 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.29 Å) Cite: Synthesis and structural characterisation of selective non-carbohydrate-based inhibitors of bacterial sialidases. Chembiochem, 13, 2012
4FPC	Crystal structure of the NanB sialidase from streptococcus pneumoniae in complex with 2-[(4-Chlorobenzyl)ammonio]ethanesulfonate Descriptor: 2-[(4-chlorobenzyl)amino]ethanesulfonic acid, GLYCEROL, Sialidase B Authors: Brear, P. Deposit date: 2012-06-22 Release date: 2012-10-31 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.32 Å) Cite: Synthesis and structural characterisation of selective non-carbohydrate-based inhibitors of bacterial sialidases. Chembiochem, 13, 2012
2OLX	Structure of NNQQ Peptide from Yeast Prion SUP35 Descriptor: NNQQ peptide derived from Yeast Prion Sup35 Authors: Nelson, R, Sawaya, M.R, Eisenberg, D. Deposit date: 2007-01-19 Release date: 2007-01-30 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (1.42 Å) Cite: Atomic structures of amyloid cross-beta spines reveal varied steric zippers. Nature, 447, 2007
3FS1	Crystal structure of HNF4a LBD in complex with the ligand and the coactivator PGC-1a fragment Descriptor: Hepatocyte nuclear factor 4-alpha, MYRISTIC ACID, PPARgamma Coactivator-1a (PGC-1a) Authors: Rha, G, Wu, G, Chi, Y. Deposit date: 2009-01-08 Release date: 2009-10-27 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Multiple binding modes between HNF4alpha and the LXXLL motifs of PGC-1alpha lead to full activation J.Biol.Chem., 284, 2009
4FQ4	Crystal structure of the NanB sialidase from streptococcus pneumoniae in complex with 2-[(4-Fluoro-3-methylbenzyl)ammonio]ethanesulfonate Descriptor: 2-[(4-fluoro-3-methylbenzyl)amino]ethanesulfonic acid, DIMETHYL SULFOXIDE, Sialidase B Authors: Brear, P. Deposit date: 2012-06-25 Release date: 2012-10-31 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.843 Å) Cite: Synthesis and structural characterisation of selective non-carbohydrate-based inhibitors of bacterial sialidases. Chembiochem, 13, 2012
4DO7	Crystal structure of an amidohydrolase (cog3618) from burkholderia multivorans (target efi-500235) with bound zn, space group c2 Descriptor: Amidohydrolase 2, SULFATE ION, ZINC ION Authors: Vetting, M.W, Toro, R, Bhosle, R, Wasserman, S.R, Morisco, L.L, Sojitra, S, Seidel, R.D, Hillerich, B, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Al Obaidi, N.F, Zencheck, W.D, Imker, H.J, Gerlt, J.A, Raushel, F.M, Almo, S.C, Enzyme Function Initiative (EFI) Deposit date: 2012-02-09 Release date: 2012-02-29 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal structure of an amidohydrolase (cog3618) from burkholderia multivorans (target efi-500235) with bound zn, space group c2 to be published
2OMX	Crystal structure of InlA S192N G194S+S/hEC1 complex Descriptor: CALCIUM ION, CHLORIDE ION, Epithelial-cadherin, ... Authors: Wollert, T, Heinz, D.W, Schubert, W.D. Deposit date: 2007-01-23 Release date: 2007-08-28 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Thermodynamically reengineering the listerial invasion complex InlA/E-cadherin. Proc.Natl.Acad.Sci.Usa, 104, 2007
2ONA	MVGGVV peptide derived from Alzheimer's A-beta, residues 35-40 Descriptor: MVGGVV peptide derived from Alzheimer's A-beta, residues 35-40 Authors: Sambashivan, S, Sawaya, M.R, Eisenberg, D. Deposit date: 2007-01-23 Release date: 2007-01-30 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.03 Å) Cite: Atomic structures of amyloid cross-beta spines reveal varied steric zippers. Nature, 447, 2007
3T11	Dimeric inhibitor of HIV-1 protease. Descriptor: (3S,11S)-11-(3-chloro-4-hydroxy-5-methoxyphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, BETA-MERCAPTOETHANOL, CHLORIDE ION, ... Authors: Brynda, J, Rezacova, P, Saskova, G.K, Kozisek, M, Konvalinka, J. Deposit date: 2011-07-21 Release date: 2012-08-22 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.22 Å) Cite: Dimeric inhibitor of HIV-1 protease. To be Published
3FTR	Structure of an amyloid forming peptide SSTNVG from IAPP (alternate polymorph) Descriptor: SSTNVG FROM ISLET AMYLOID POLYPEPTIDE Authors: Landau, M, Eisenberg, D. Deposit date: 2009-01-13 Release date: 2009-06-30 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.61 Å) Cite: Molecular mechanisms for protein-encoded inheritance. Nat.Struct.Mol.Biol., 16, 2009
4DQH	Crystal Structure of (R14C/E65C) HIV-1 Protease in complex with DRV Descriptor: (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE, GLYCEROL, Wild-type HIV-1 protease dimer Authors: Schiffer, C.A, Mittal, S. Deposit date: 2012-02-15 Release date: 2012-03-07 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.79 Å) Cite: Hydrophobic core flexibility modulates enzyme activity in HIV-1 protease. J.Am.Chem.Soc., 134, 2012
3FUB	Crystal structure of GDNF-GFRalpha1 complex Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... Authors: Parkash, V, Goldman, A. Deposit date: 2009-01-14 Release date: 2009-06-02 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Comparison of GFL-GFRalpha complexes: further evidence relating GFL bend angle to RET signalling Acta Crystallogr.,Sect.F, 65, 2009
4DQQ	Ternary complex of Bacillus DNA Polymerase I Large Fragment E658A, DNA duplex, and rCTP (paired with dG of template) in presence of Mg2+ Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CYTIDINE-5'-TRIPHOSPHATE, ... Authors: Wang, W, Beese, L.S. Deposit date: 2012-02-16 Release date: 2012-06-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.595 Å) Cite: Structural factors that determine selectivity of a high fidelity DNA polymerase for deoxy-, dideoxy-, and ribonucleotides. J.Biol.Chem., 287, 2012
4DQS	Binary complex of Bacillus DNA Polymerase I Large Fragment and duplex DNA with rC in primer terminus paired with dG of template Descriptor: CYTIDINE-5'-TRIPHOSPHATE, DNA (5'-D(*GP*A*CP*GP*TP*AP*CP*GP*TP*GP*AP*TP*CP*GP*CP*A)-3'), DNA polymerase, ... Authors: Wang, W, Beese, L.S. Deposit date: 2012-02-16 Release date: 2012-06-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.66 Å) Cite: Structural factors that determine selectivity of a high fidelity DNA polymerase for deoxy-, dideoxy-, and ribonucleotides. J.Biol.Chem., 287, 2012
4DRO	EVALUATION OF SYNTHETIC FK506 ANALOGS AS LIGANDS FOR FKBP51 AND FKBP52: COMPLEX OF FKBP51 WITH (1R)-3-(3,4-dimethoxyphenyl)-1-phenylpropyl (2S)-1-{[(1R,2S)-2-ethyl-1-hydroxycyclohexyl](oxo)acetyl}piperidine-2-carboxylate Descriptor: Peptidyl-prolyl cis-trans isomerase FKBP5, {3-[(1R)-3-(3,4-dimethoxyphenyl)-1-({[(2S)-1-{[(1R,2S)-2-ethyl-1-hydroxycyclohexyl](oxo)acetyl}piperidin-2-yl]carbonyl}oxy)propyl]phenoxy}acetic acid Authors: Gopalakrishnan, R, Kozany, C, Gaali, S, Kress, C, Hoogeland, B, Bracher, A, Hausch, F. Deposit date: 2012-02-17 Release date: 2012-05-16 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.1 Å) Cite: Evaluation of Synthetic FK506 Analogues as Ligands for the FK506-Binding Proteins 51 and 52. J.Med.Chem., 55, 2012
4DSF	Ternary complex of Bacillus DNA Polymerase I Large Fragment F710Y, DNA duplex, and rCTP (paired with dG of template) in presence of Mn2+ Descriptor: CYTIDINE-5'-TRIPHOSPHATE, DNA (5'-D(*CP*AP*TP*GP*GP*GP*AP*GP*TP*CP*AP*GP*G)-3'), DNA (5'-D(*CP*CP*TP*GP*AP*CP*TP*CP*(DOC))-3'), ... Authors: Wang, W, Beese, L.S. Deposit date: 2012-02-18 Release date: 2012-06-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.661 Å) Cite: Structural factors that determine selectivity of a high fidelity DNA polymerase for deoxy-, dideoxy-, and ribonucleotides. J.Biol.Chem., 287, 2012
3FQJ	Crystal Structure of the Mouse Dom3Z in Complex with GDP Descriptor: GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Protein Dom3Z Authors: Xiang, S, Tong, L. Deposit date: 2009-01-07 Release date: 2009-02-03 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.623 Å) Cite: Structure and function of the 5'-->3' exoribonuclease Rat1 and its activating partner Rai1. Nature, 458, 2009
3FRR	Structure of human IST1(NTD) - (residues 1-189)(P21) Descriptor: Uncharacterized protein KIAA0174 Authors: Schubert, H.L, Hill, C.P, Bajorek, M, Sundquist, W.I. Deposit date: 2009-01-08 Release date: 2009-06-30 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Structural basis for ESCRT-III protein autoinhibition. Nat.Struct.Mol.Biol., 16, 2009
4DU2	cytochrome P450 BM3h-B7 MRI sensor bound to dopamine Descriptor: L-DOPAMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome P450 BM3 variant B7 Authors: Brustad, E.M, Lelyveld, V.S, Snow, C.D, Crook, N, Martinez, F.M, Scholl, T.J, Jasanoff, A, Arnold, F.H. Deposit date: 2012-02-21 Release date: 2012-06-13 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Structure-guided directed evolution of highly selective p450-based magnetic resonance imaging sensors for dopamine and serotonin. J.Mol.Biol., 422, 2012

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