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2HYY
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Human Abl kinase domain in complex with imatinib (STI571, Glivec)
分子名称: 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE, Proto-oncogene tyrosine-protein kinase ABL1
著者Cowan-Jacob, S.W, Fendrich, G, Liebetanz, J, Fabbro, D, Manley, P.
登録日2006-08-08
公開日2007-01-16
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural biology contributions to the discovery of drugs to treat chronic myelogenous leukaemia.
ACTA CRYSTALLOGR.,SECT.D, 63, 2007
8ZXG
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BU of 8zxg by Molmil
Crystal structure of Paraoxonase from Bacillus sp. strain S3wahi
分子名称: GLYCEROL, MAGNESIUM ION, Paraoxonase from Bacillus sp. strain S3wahi, ...
著者Azman, A.A, Muhd Noor, N.D, Leow, A.T.C, Mohd Noor, S.A, Mohamad Ali, M.S.
登録日2024-06-14
公開日2025-06-18
最終更新日2025-06-25
実験手法X-RAY DIFFRACTION (1.494 Å)
主引用文献Crystal structure analysis of Paraoxonase from Bacillus sp. strain S3wahi
To Be Published
2HZK
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BU of 2hzk by Molmil
Crystal structures of a sodium-alpha-keto acid binding subunit from a TRAP transporter in its open form
分子名称: GLYCEROL, TRAP-T family sorbitol/mannitol transporter, periplasmic binding protein, ...
著者Gonin, S, Arnoux, P, Pierru, B, Alonso, B, Sabaty, M, Pignol, D.
登録日2006-08-09
公開日2007-04-03
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Crystal structures of an Extracytoplasmic Solute Receptor from a TRAP transporter in its open and closed forms reveal a helix-swapped dimer requiring a cation for alpha-keto acid binding.
Bmc Struct.Biol., 7, 2007
5JRS
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BU of 5jrs by Molmil
CRYSTAL STRUCTURE OF BRUTON AGAMMAGLOBULINEMIA TYROSINE KINASE COMPLEXED WITH 4-[2-FLUORO-3-(4-OXO -3,4-DIHYDROQUINAZOLIN-3-YL)PHENYL]-7-(2-HYDROXYPROPAN-2-Y L)-9H-CARBAZOLE-1-CARBOXAMIDE
分子名称: 4-[2-fluoro-3-(4-oxoquinazolin-3(4H)-yl)phenyl]-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide, Tyrosine-protein kinase BTK
著者Muckelbauer, J.K.
登録日2016-05-06
公開日2016-08-31
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献Small Molecule Reversible Inhibitors of Bruton's Tyrosine Kinase (BTK): Structure-Activity Relationships Leading to the Identification of 7-(2-Hydroxypropan-2-yl)-4-[2-methyl-3-(4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]-9H-carbazole-1-carboxamide (BMS-935177).
J.Med.Chem., 59, 2016
8ZXB
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BU of 8zxb by Molmil
Structure of aminotransferase from Mycolicibacterium neoaurum in complex with PLP
分子名称: Branched-chain amino acid aminotransferase, PYRIDOXAL-5'-PHOSPHATE
著者Wei, H, Cong, L, Wang, J, You, S, Liu, W.
登録日2024-06-14
公開日2025-06-18
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structure of aminotransferase from Mycolicibacterium neoaurum in complex with PLP
To Be Published
8ZXY
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BU of 8zxy by Molmil
sweet protein MNEI-Mut 6-2
分子名称: Monellin chain B,Monellin chain A
著者You, T.J, Liu, S.
登録日2024-06-15
公開日2025-06-18
最終更新日2025-07-09
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Structural Basis for the Exceptional Thermal Stability of the Boiling-Resistant Sweet Protein MNEI.
J.Agric.Food Chem., 73, 2025
2I3V
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BU of 2i3v by Molmil
Measurement of conformational changes accompanying desensitization in an ionotropic glutamate receptor: Structure of G725C mutant
分子名称: GLUTAMIC ACID, Glutamate receptor 2, ZINC ION
著者Armstrong, N, Jasti, J, Beich-Frandsen, M, Gouaux, E.
登録日2006-08-21
公開日2006-10-17
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Measurement of Conformational Changes accompanying Desensitization in an Ionotropic Glutamate Receptor.
Cell(Cambridge,Mass.), 127, 2006
8ZU4
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BU of 8zu4 by Molmil
Crystal Structure of Methyl parathion hydrolase mutant A127L/I145L/Q272D/S279A/S304P
分子名称: Methyl parathion hydrolase, ZINC ION
著者Xu, F, Fan, S.
登録日2024-06-07
公開日2025-06-11
実験手法X-RAY DIFFRACTION (1.39 Å)
主引用文献Crystal Structure of Methyl parathion hydrolase mutant A127L/I145L/Q272D/S279A/S304P
To Be Published
8ZXJ
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BU of 8zxj by Molmil
Sweet protein MNEI-Mut 6-1
分子名称: Monellin chain B,Monellin chain A
著者You, T.J, Liu, S.
登録日2024-06-14
公開日2025-06-18
最終更新日2025-07-09
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural Basis for the Exceptional Thermal Stability of the Boiling-Resistant Sweet Protein MNEI.
J.Agric.Food Chem., 73, 2025
2I4G
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BU of 2i4g by Molmil
Structural studies of protein tyrosine phosphatase beta catalytic domain in complex with a sulfamic acid (soaking experiment)
分子名称: CHLORIDE ION, N-(TERT-BUTOXYCARBONYL)-L-TYROSYL-N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE, Receptor-type tyrosine-protein phosphatase beta
著者Evdokimov, A.G, Pokross, M.E, Walter, R.L, Mekel, M.
登録日2006-08-21
公開日2006-08-29
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Engineering the catalytic domain of human protein tyrosine phosphatase beta for structure-based drug discovery.
Acta Crystallogr.,Sect.D, 62, 2006
2I0G
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BU of 2i0g by Molmil
Benzopyrans are Selective Estrogen Receptor beta Agonists (SERBAs) with Novel Activity in Models of Benign Prostatic Hyperplasia
分子名称: (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, Estrogen receptor beta
著者Wang, Y.
登録日2006-08-10
公開日2006-10-24
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Benzopyrans are selective estrogen receptor Beta agonists with novel activity in models of benign prostatic hyperplasia.
J.Med.Chem., 49, 2006
8HO8
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BU of 8ho8 by Molmil
The cryo-EM structure of cellobiose phosphorylase from Clostridium thermocellum in complex with cellobiose
分子名称: Cellobiose phosphorylase, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose
著者Iriya, S, Kuga, T, Sunagawa, N, Igarashi, K.
登録日2022-12-09
公開日2023-12-13
実験手法ELECTRON MICROSCOPY (2.24 Å)
主引用文献The cryo-EM structure of cellobiose phosphorylase from Clostridium thermocellum in complex with cellobiose
To Be Published
8ZXI
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BU of 8zxi by Molmil
Peptide channel interactions in the truncated VhChiP nanopore
分子名称: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE, ASP-GLY-ALA-ASN-SER-ASP, Chitoporin, ...
著者Sanram, S, Suginta, W, Robinson, R.C.
登録日2024-06-14
公開日2025-06-18
実験手法X-RAY DIFFRACTION (3.12 Å)
主引用文献Structure and function of truncated VhChiP
To Be Published
5JW5
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BU of 5jw5 by Molmil
Structure of MEDI8852 Fab Fragment
分子名称: MEDI8852 Heavy chain, MEDI8852 Light chain, PHOSPHATE ION
著者Neu, U, Collins, P.J, Walker, P.A, Vorlaender, M.K, Ogrodowicz, R.W, Martin, S.R, Gamblin, S.J, Skehel, J.J.
登録日2016-05-11
公開日2016-08-03
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure and Function Analysis of an Antibody Recognizing All Influenza A Subtypes.
Cell, 166, 2016
7RTK
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BU of 7rtk by Molmil
Structure of the (NIAU)2 complex with N-terminal mutation of ISCU2 Y35D at 2.5 A resolution
分子名称: 1,2-ETHANEDIOL, 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, ...
著者Boniecki, M.T, Cygler, M.
登録日2021-08-13
公開日2021-08-25
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献The essential function of ISCU2 and its conserved N-terminus in Fe/S cluster biogenesis
To Be Published
6LFL
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BU of 6lfl by Molmil
Crystal structure of a class A GPCR
分子名称: 4-[[3,4-bis(oxidanylidene)-2-[[(1~{R})-1-(4-propan-2-ylfuran-2-yl)propyl]amino]cyclobuten-1-yl]amino]-~{N},~{N}-dimethyl-3-oxidanyl-pyridine-2-carboxamide, C-X-C chemokine receptor type 2,GlgA glycogen synthase,C-X-C chemokine receptor type 2
著者Liu, Z.J, Hua, T, Liu, K.W, Wu, L.J.
登録日2019-12-03
公開日2020-09-02
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structural basis of CXC chemokine receptor 2 activation and signalling.
Nature, 585, 2020
8ZW1
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BU of 8zw1 by Molmil
citrate synthases complexed with oxaloacetate and acetyl-CoA
分子名称: ACETYL COENZYME *A, CITRIC ACID, COENZYME A, ...
著者Yang, L.Y, Fang, Y.J.
登録日2024-06-12
公開日2025-06-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献citrate synthases complexed with oxaloacetate and acetyl-CoA
To Be Published
2I0T
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BU of 2i0t by Molmil
Crystal structure of phenylacetaldehyde derived R-carbinolamine adduct of aromatic amine dehydrogenase
分子名称: 2-PHENYL-ETHANOL, Aromatic amine dehydrogenase
著者Roujeinikova, A, Leys, D.
登録日2006-08-11
公開日2007-04-24
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献New insights into the reductive half-reaction mechanism of aromatic amine dehydrogenase revealed by reaction with carbinolamine substrates.
J.Biol.Chem., 282, 2007
8ZWQ
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BU of 8zwq by Molmil
pseudorabies virus dUTPase structure
分子名称: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, MAGNESIUM ION, dUTPase
著者Wang, Y.
登録日2024-06-13
公開日2025-06-18
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Structural definition of pseudorabies virus dUTPase reveals a novel folding dimer in the herpesviruses family
To Be Published
2VHL
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BU of 2vhl by Molmil
The Three-dimensional structure of the N-Acetylglucosamine-6- phosphate deacetylase from Bacillus subtilis
分子名称: 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose, FE (III) ION, N-ACETYLGLUCOSAMINE-6-PHOSPHATE DEACETYLASE, ...
著者Vincent, F, Yates, D, Garman, E, Davies, G.J.
登録日2007-11-22
公開日2007-12-04
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献The Three-Dimensional Structure of the N-Acetylglucosamine-6-Phosphate Deacetylase from Bacillus Subtilis
J.Biol.Chem., 279, 2004
8ZYB
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BU of 8zyb by Molmil
a-KG dependent oxygenase
分子名称: DhiD, FE (III) ION
著者Fan, A, Fan, S, Wu, M, Sun, Z.
登録日2024-06-17
公開日2025-06-18
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献a-KG dependent oxygenase
To Be Published
8ZWT
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BU of 8zwt by Molmil
Crystal structure of atypical two cysteine thiol peroxidase from Staphylococcus aureus
分子名称: (2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, Thiol peroxidase
著者Shukla, M, Maji, S, Yadav, V.K, Bhattacharyya, S.
登録日2024-06-13
公開日2025-06-18
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Crystal structure of atypical two cysteine thiol peroxidase from Staphylococcus aureus
To Be Published
5JQC
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BU of 5jqc by Molmil
Crystal structure putative autolysin from Listeria monocytogenes
分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, Lmo1076 protein, ...
著者Chang, C, Zhou, M, Shatsman, S, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2016-05-04
公開日2016-05-18
最終更新日2024-12-25
実験手法X-RAY DIFFRACTION (2.149 Å)
主引用文献Crystal structure putative autolysin from Listeria monocytogenes
To Be Published
8ZU5
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BU of 8zu5 by Molmil
Crystal Structure of Methyl parathion hydrolase mutant A66D/I143V/I145L/Q272D/S279A/
分子名称: Methyl parathion hydrolase, ZINC ION
著者Xu, F, Fan, S.
登録日2024-06-07
公開日2025-06-11
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Crystal Structure of Methyl parathion hydrolase mutant A66D/I143V/I145L/Q272D/S279A/
To Be Published
2I2A
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BU of 2i2a by Molmil
Crystal structure of LmNADK1 from Listeria monocytogenes
分子名称: GLYCEROL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Probable inorganic polyphosphate/ATP-NAD kinase 1
著者Labesse, G.
登録日2006-08-16
公開日2007-08-07
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献NAD kinases use substrate-assisted catalysis for specific recognition of NAD.
J.Biol.Chem., 282, 2007

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件を2025-07-09に公開中

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