PDB: 19228 resultsInfo pagesStatus searchChemie searchBIRD

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5HCU	Crystal structure of mouse acetylchoinesterase inhibited by DFP Descriptor: Acetylcholinesterase Authors: Tran, T.H, Tong, L. Deposit date: 2016-01-04 Release date: 2016-01-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.4151 Å) Cite: Discovery of New Classes of Compounds that Reactivate Acetylcholinesterase Inhibited by Organophosphates. Chembiochem, 16, 2015
5H6B	Crystal structure of a thermostable lipase from Marine Streptomyces Descriptor: ACETATE ION, IMIDAZOLE, Putative secreted lipase, ... Authors: Hou, S, Zhao, Z, Liu, J. Deposit date: 2016-11-11 Release date: 2017-09-20 Last modified: 2017-11-01 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Crystal structure of a lipase from Streptomyces sp. strain W007 - implications for thermostability and regiospecificity FEBS J., 284, 2017
5FHG	Structure of unliganded Pif1 from Bacteroides sp Descriptor: Uncharacterized protein Authors: Zhou, X, Ren, W, Bharath, S.R, Song, H. Deposit date: 2015-12-22 Release date: 2016-03-30 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2 Å) Cite: Structural and Functional Insights into the Unwinding Mechanism of Bacteroides sp Pif1 Cell Rep, 14, 2016
7TYH	Human Amylin2 Receptor in complex with Gs and human calcitonin peptide Descriptor: Calcitonin, Calcitonin receptor, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ... Authors: Cao, J, Belousoff, M.J, Johnson, R.M, Wootten, D.L, Sexton, P.M. Deposit date: 2022-02-13 Release date: 2022-03-23 Last modified: 2022-04-06 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: A structural basis for amylin receptor phenotype. Science, 375, 2022
7TYY	Human Amylin2 Receptor in complex with Gs and salmon calcitonin peptide Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL HEMISUCCINATE, Calcitonin receptor, ... Authors: Cao, J, Belousoff, M.J, Johnson, R.M, Wootten, D.L, Sexton, P.M. Deposit date: 2022-02-14 Release date: 2022-03-23 Last modified: 2024-10-30 Method: ELECTRON MICROSCOPY (3 Å) Cite: A structural basis for amylin receptor phenotype. Science, 375, 2022
2CPK	CRYSTAL STRUCTURE OF THE CATALYTIC SUBUNIT OF CYCLIC ADENOSINE MONOPHOSPHATE-DEPENDENT PROTEIN KINASE Descriptor: PEPTIDE INHIBITOR 20-MER, cAMP-DEPENDENT PROTEIN KINASE, CATALYTIC SUBUNIT Authors: Knighton, D.R, Zheng, J, Teneyck, L.F, Ashford, V.A, Xuong, N.-H, Taylor, S.S, Sowadski, J.M. Deposit date: 1992-10-21 Release date: 1993-01-15 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Crystal structure of the catalytic subunit of cyclic adenosine monophosphate-dependent protein kinase. Science, 253, 1991
6C0U	Crystal structure of cAMP-dependent protein kinase Calpha subunit bound with N46 Descriptor: DIMETHYL SULFOXIDE, N-[(3R,4R)-4-{[4-(2-fluoro-3-methoxy-6-propoxybenzene-1-carbonyl)benzene-1-carbonyl]amino}pyrrolidin-3-yl]-1H-indazole-5-carboxamide, PHOSPHATE ION, ... Authors: Qin, L, Sankaran, B, Kim, C. Deposit date: 2018-01-02 Release date: 2018-05-30 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.65 Å) Cite: Structural basis for selective inhibition of human PKG I alpha by the balanol-like compound N46. J. Biol. Chem., 293, 2018
7TYX	Human Amylin2 Receptor in complex with Gs and rat amylin peptide Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL HEMISUCCINATE, Calcitonin receptor, ... Authors: Cao, J, Belousoff, M.J, Johnson, R.M, Wootten, D.L, Sexton, P.M. Deposit date: 2022-02-14 Release date: 2022-03-30 Last modified: 2024-10-16 Method: ELECTRON MICROSCOPY (2.55 Å) Cite: A structural basis for amylin receptor phenotype. Science, 375, 2022
5M0C	Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with the Fasudil-fragment isoquinoline-5-sulfonamide Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, DIMETHYL SULFOXIDE, cAMP-dependent protein kinase catalytic subunit alpha, ... Authors: Wienen-Schmidt, B, Heine, A, Klebe, G. Deposit date: 2016-10-04 Release date: 2018-06-06 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.734 Å) Cite: Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with different Fasudil-derivatives To be Published
5M0L	Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with the methylated Fasudil-derived fragment N-methylisoquinoline-5-sulfonamide (Ligand 02) Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha, ... Authors: Wienen-Schmidt, B, Heine, A, Klebe, G. Deposit date: 2016-10-05 Release date: 2018-06-06 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.465 Å) Cite: Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with different Fasudil-derivatives To Be Published
5LR6	Crystal Structure of COMT in complex with [3-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]-(4-phenylpiperazin-1-yl)methanone Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, CHLORIDE ION, Catechol O-methyltransferase, ... Authors: Ehler, A, Lerner, C, Rudolph, M.G. Deposit date: 2016-08-18 Release date: 2016-08-31 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Crystal Structure of COMT in complex with [3-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]-(4-phenylpiperazin-1-yl)methanone To be published
6DC2	Crystal structure of Desulfovibrio vulgaris carbon monoxide dehydrogenase C301S variant Descriptor: Carbon monoxide dehydrogenase, FE (III) ION, FE(4)-NI(1)-S(4) CLUSTER, ... Authors: Wittenborn, E.C, Drennan, C.L. Deposit date: 2018-05-04 Release date: 2018-10-03 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.992 Å) Cite: Redox-dependent rearrangements of the NiFeS cluster of carbon monoxide dehydrogenase. Elife, 7, 2018
5LQK	Crystal Structure of COMT in complex with N-[(E)-3-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]prop-2-enyl]-2,3-dihydroxy-5-[(4-methylphenyl)methyl]benzamide Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, CHLORIDE ION, Catechol O-methyltransferase, ... Authors: Ehler, A, Lerner, C, Rudolph, M.G. Deposit date: 2016-08-17 Release date: 2016-08-31 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.24 Å) Cite: Crystal Structure of COMT To be published
5M75	Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with a (S)-methyl substitued Fasudil-derivative Descriptor: 5-[[(2~{S})-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline, DIMETHYL SULFOXIDE, cAMP-dependent protein kinase catalytic subunit alpha, ... Authors: Wienen-Schmidt, B, Heine, A, Klebe, G. Deposit date: 2016-10-26 Release date: 2018-06-06 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.538 Å) Cite: Cocrystal structure of cAMP-dependent Protein Kinase (PKA) in complex with differently methylated Fasudil-derived ligands. To be Published
5MHI	cAMP-dependent Protein Kinase A from Cricetulus griseus in complex with fragment like molecule (5-chloro-2-methoxyphenyl)methanamine Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (5-chloranyl-2-methoxy-phenyl)methylazanium, DIMETHYL SULFOXIDE, ... Authors: Siefker, C, Heine, A, Klebe, G. Deposit date: 2016-11-24 Release date: 2017-12-20 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.489 Å) Cite: A crystallographic fragment study with cAMP-dependent protein kinase A To Be Published
5NTJ	Crystal Structure of the Protein-Kinase A catalytic subunit from Criteculus Griseus in complex with compound RKp032 Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, beta-D-ribopyranose, cAMP-dependent protein kinase catalytic subunit alpha, ... Authors: Mueller, J.M, Heine, A, Klebe, G. Deposit date: 2017-04-28 Release date: 2018-05-30 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.56 Å) Cite: Crystal structure of the Protein-Kinase A catalytic subunit from Criteculus Griseus in complex with compound RKp032 To Be Published
5O0E	Crystal Structure of the Protein-Kinase A catalytic subunit from Criteculus Griseus in complex with compounds RKp120 and Fasudil Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE, RKp120, ... Authors: Mueller, J.M, Heine, A, Klebe, G. Deposit date: 2017-05-16 Release date: 2018-05-30 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Conceptional Design of Self-Assembling Bisubstrate-like Inhibitors of Protein Kinase A Resulting in a Boronic Acid Glutamate Linkage Acs Omega, 2019
5A63	Cryo-EM structure of the human gamma-secretase complex at 3.4 angstrom resolution. Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... Authors: Bai, X, Yan, C, Yang, G, Lu, P, Ma, D, Sun, L, Zhou, R, Scheres, S.H.W, Shi, Y. Deposit date: 2015-06-24 Release date: 2015-08-05 Last modified: 2020-07-29 Method: ELECTRON MICROSCOPY (3.4 Å) Cite: An Atomic Structure of Human Gamma-Secretase Nature, 525, 2015
5FHD	Structure of Bacteroides sp Pif1 complexed with tailed dsDNA resulting in ssDNA bound complex Descriptor: ADENOSINE-5'-DIPHOSPHATE, DNA (5'-D(*TP*TP*TP*TP*TP*TP*TP*CP*CP*GP*GP*GP*GP*CP*CP*GP*CP*GP*C)-3'), MAGNESIUM ION, ... Authors: Zhou, X, Ren, W, Bharath, S.R, Song, H. Deposit date: 2015-12-22 Release date: 2016-03-30 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2 Å) Cite: Structural and Functional Insights into the Unwinding Mechanism of Bacteroides sp Pif1 Cell Rep, 14, 2016
5FN2	Cryo-EM structure of gamma secretase in complex with a drug DAPT Descriptor: Gamma-secretase subunit APH-1A, Gamma-secretase subunit PEN-2, Nicastrin, ... Authors: Bai, X.C, Rajendra, E, Yang, G.H, Shi, Y.G, Scheres, S.H.W. Deposit date: 2015-11-10 Release date: 2015-12-16 Last modified: 2019-09-04 Method: ELECTRON MICROSCOPY (4.2 Å) Cite: Sampling the conformational space of the catalytic subunit of human gamma-secretase. Elife, 4, 2015
2B57	Guanine Riboswitch C74U mutant bound to 2,6-diaminopurine Descriptor: 65-MER, 9H-PURINE-2,6-DIAMINE, ACETATE ION, ... Authors: Gilbert, S.D, Stoddard, C.D, Wise, S.J, Batey, R.T. Deposit date: 2005-09-27 Release date: 2006-05-23 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Thermodynamic and kinetic characterization of ligand binding to the purine riboswitch aptamer domain. J.Mol.Biol., 359, 2006
5FN3	Cryo-EM structure of gamma secretase in class 1 of the apo- state ensemble Descriptor: Gamma-secretase subunit APH-1A, Gamma-secretase subunit PEN-2, Nicastrin, ... Authors: Bai, X.C, Rajendra, E, Yang, G.H, Shi, Y.G, Scheres, S.H.W. Deposit date: 2015-11-10 Release date: 2015-12-16 Last modified: 2024-10-09 Method: ELECTRON MICROSCOPY (4.1 Å) Cite: Sampling the conformational space of the catalytic subunit of human gamma-secretase. Elife, 4, 2015
2B0H	Solution structure of VBS3 fragment of talin Descriptor: Talin-1 Authors: Gingras, A.R, Vogel, K.P, Steinhoff, H.J, Ziegler, W.H, Patel, B, Emsley, J, Critchley, D.R, Roberts, G.C, Barsukov, I.L. Deposit date: 2005-09-14 Release date: 2006-01-17 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Structural and Dynamic Characterization of a Vinculin Binding Site in the Talin Rod Biochemistry, 45, 2006
2B2T	Tandem chromodomains of human CHD1 complexed with Histone H3 Tail containing trimethyllysine 4 and phosphothreonine 3 Descriptor: Chromodomain-helicase-DNA-binding protein 1, Histone H3 tail Authors: Flanagan IV, J.F, Mi, L.-Z, Chruszcz, M, Cymborowski, M, Clines, K.L, Kim, Y, Minor, W, Rastinejad, F, Khorasanizadeh, S. Deposit date: 2005-09-19 Release date: 2005-12-27 Last modified: 2022-04-13 Method: X-RAY DIFFRACTION (2.45 Å) Cite: Double chromodomains cooperate to recognize the methylated histone H3 tail. Nature, 438, 2005
5O5M	Crystal Structure of the Protein-Kinase A catalytic subunit from Criteculus Griseus in complex with compounds RKp120 and RKp117 Descriptor: CHLORIDE ION, RKp120, [2-[(4-isoquinolin-5-ylsulfonyl-1,4-diazepan-1-yl)methyl]phenyl]boronic acid, ... Authors: Mueller, J.M, Heine, A, Klebe, G. Deposit date: 2017-06-02 Release date: 2018-06-13 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.583 Å) Cite: Conceptional Design of Self-Assembling Bisubstrate-like Inhibitors of Protein Kinase A Resulting in a Boronic Acid Glutamate Linkage Acs Omega, 2019

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