PDB: 17012 件ウェブページステータス検索Chemie searchBIRD

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4A04	Structure of the DNA-bound T-box domain of human TBX1, a transcription factor associated with the DiGeorge syndrome 分子名称: DNA, T-BOX TRANSCRIPTION FACTOR TBX1 著者 El Omari, K, De Mesmaeker, J, Karia, D, Ginn, H, Bhattacharya, S, Mancini, E.J. 登録日 2011-09-07 公開日 2011-10-12 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (2.58 Å) 主引用文献 Structure of the DNA-Bound T-Box Domain of Human Tbx1, a Transcription Factor Associated with the Digeorge Syndrome Proteins, 80, 2012
5NR3	Human DNMT3B PWWP domain in complex with ethambutol 分子名称: DNA (cytosine-5)-methyltransferase 3B, Ethambutol, SULFATE ION 著者 Rondelet, G, Wouters, J. 登録日 2017-04-21 公開日 2018-05-30 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Targeting PWWP domain of DNA methyltransferase 3B for epigenetic cancer therapy: Identification and structural characterization of new potential protein-protein interaction inhibitors To be published
6GXK	Crystal structure of Aldo-Keto Reductase 1C3 (AKR1C3) complexed with inhibitor. 分子名称: 1,2-ETHANEDIOL, 4-[[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]methyl]-1,2,5-oxadiazol-3-one, Aldo-keto reductase family 1 member C3, ... 著者 Goyal, P, Wahlgren, W.Y, Friemann, R. 登録日 2018-06-27 公開日 2019-05-08 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Bioisosteres of Indomethacin as Inhibitors of Aldo-Keto Reductase 1C3. Acs Med.Chem.Lett., 10, 2019
1QYV	Crystal structure of human estrogenic 17beta-hydroxysteroid dehydrogenase complex with NADP 分子名称: Estradiol 17 beta-dehydrogenase 1, GLYCEROL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Shi, R, Lin, S.X. 登録日 2003-09-12 公開日 2004-08-03 最終更新日 2023-08-23 実験手法 X-RAY DIFFRACTION (1.81 Å) 主引用文献 Cofactor hydrogen bonding onto the protein main chain is conserved in the short chain dehydrogenase/reductase family and contributes to nicotinamide orientation. J.Biol.Chem., 279, 2004
6ONY	BRD2_Bromodomain1 complex with inhibitor 744 分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 2, N-ethyl-4-[2-(4-fluoro-2,6-dimethylphenoxy)-5-(2-hydroxypropan-2-yl)phenyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide 著者 Longenecker, K.L, Bigelow, L. 登録日 2019-04-22 公開日 2020-01-29 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.98 Å) 主引用文献 Selective inhibition of the BD2 bromodomain of BET proteins in prostate cancer. Nature, 578, 2020
6ULM	Crystal structure of human cadherin 17 EC1-2 分子名称: CALCIUM ION, Cadherin-17 著者 Gray, M.E, Sotomayor, M. 登録日 2019-10-08 公開日 2021-03-17 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Crystal structure of the nonclassical cadherin-17 N-terminus and implications for its adhesive binding mechanism. Acta Crystallogr.,Sect.F, 77, 2021
2MJK	Nmr structure of hen egg beta-defensin gallin (chicken ovo-defensin) 分子名称: Gallin protein 著者 Landon, C, Meudal, H. 登録日 2014-01-10 公開日 2014-01-22 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Three-dimensional NMR Structure of Hen Egg Gallin (Chicken Ovodefensin) Reveals a New Variation of the beta-Defensin Fold. J.Biol.Chem., 289, 2014
1WPD	Evidence for domain-specific recognition of SK and Kv channels by MTX and HsTx1 scorpion toxins 分子名称: Potassium channel toxin alpha-KTx 6.2,Potassium channel toxin alpha-KTx 6.3 著者 Regaya, I, Beeton, C, Ferrat, G, Andreotti, N, Chandy, G.K, Darbon, H, De Waard, M, Sabatier, J.M. 登録日 2004-09-01 公開日 2004-10-19 最終更新日 2019-12-18 実験手法 SOLUTION NMR 主引用文献 Evidence for domain-specific recognition of SK and Kv channels by MTX and HsTx1 scorpion toxins J.Biol.Chem., 279, 2004
4UJ3	Crystal structure of human Rab11-Rabin8-FIP3 分子名称: MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, RAB-3A-INTERACTING PROTEIN, ... 著者 Vetter, M, Lorentzen, E. 登録日 2015-04-08 公開日 2015-08-12 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Structure of Rab11-Fip3-Rabin8 Reveals Simultaneous Binding of Fip3 and Rabin8 Effectors to Rab11. Nat.Struct.Mol.Biol., 22, 2015
2M05	Structure of module 2 from the E1 domain of C. elegans APL-1 分子名称: Beta-amyloid-like protein 著者 Hinds, M.G, Leong, S. 登録日 2012-10-20 公開日 2013-10-23 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Quantification of copper binding to amyloid precursor protein domain 2 and its Caenorhabditis elegans ortholog. Implications for biological function. Metallomics, 6, 2013
3NQ8	Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R4 8/5A 分子名称: BENZAMIDINE, NITRATE ION, deoxyribose phosphate aldolase 著者 Khersonsky, O, Rothlisberge, D, Wollacott, A.M, Dym, O, Baker, D, Tawfik, D.S, Israel Structural Proteomics Center (ISPC) 登録日 2010-06-29 公開日 2011-02-09 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution J.Mol.Biol., 407, 2011
4HRA	Crystal Structure of DOT1L in Complex with EPZ-5676 分子名称: 5'-[{cis-3-[2-(5-tert-butyl-1H-benzimidazol-2-yl)ethyl]cyclobutyl}(propan-2-yl)amino]-5'-deoxyadenosine, Histone-lysine N-methyltransferase, H3 lysine-79 specific, ... 著者 Jin, L. 登録日 2012-10-26 公開日 2013-07-31 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (3.15 Å) 主引用文献 Potent inhibition of DOT1L as treatment of MLL-fusion leukemia. Blood, 122, 2013
1WMM	Crystal structure of PH1033 from Pyrococcus horikoshii Ot3 分子名称: Hypothetical UPF0310 protein PH1033 著者 Sugahara, M, Kunishima, N, RIKEN Structural Genomics/Proteomics Initiative (RSGI) 登録日 2004-07-12 公開日 2005-08-23 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Nucleant-mediated protein crystallization with the application of microporous synthetic zeolites. Acta Crystallogr.,Sect.D, 64, 2008
4MML	D40A Hfq from Pseudomonas aeruginosa 分子名称: MAGNESIUM ION, Protein hfq, SULFATE ION, ... 著者 Murina, V.N, Filimonov, V.V, Melnik, B.S, Uhlein, M, Mueller, U, Weiss, M, Nikulin, A.D. 登録日 2013-09-09 公開日 2014-07-09 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.801 Å) 主引用文献 Effect of conserved intersubunit amino Acid substitutions on hfq protein structure and stability. Biochemistry Mosc., 79, 2014
3NPV	Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution 分子名称: deoxyribose phosphate aldolase 著者 Khersonsky, O, Rothlisberge, D, Wollacott, A.M, Dym, O, Baker, D, Tawfik, D.S, Israel Structural Proteomics Center (ISPC) 登録日 2010-06-29 公開日 2011-02-09 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.48 Å) 主引用文献 Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution J.Mol.Biol., 407, 2011
6EK6	Crystal structure of KDM5B in complex with S49195a. 分子名称: 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, Lysine-specific demethylase 5B,Lysine-specific demethylase 5B, ... 著者 Srikannathasan, V, Szykowska, A, Newman, J.A, Ruda, G.F, Strain-Damerell, C, Burgess-Brown, N.A, Vazquez-Rodriguez, S, Wright, M, Brennan, P.E, Arrowsmith, C.H, Edwards, A, Bountra, C, Oppermann, U, Huber, K, von Delft, F. 登録日 2017-09-25 公開日 2018-03-14 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Crystal structure of KDM5B in complex with S49195a. To be published
2MDQ	A Novel 4/7-Conotoxin LvIA from Conus lividus that Selectively Blocks 3 2 vs. 6/3 2 3 Nicotinic Acetylcholine Receptors 分子名称: Alpha-conotoxin-like 著者 Schroeder, C.I. 登録日 2013-09-16 公開日 2014-02-12 最終更新日 2023-12-27 実験手法 SOLUTION NMR 主引用文献 A novel alpha 4/7-conotoxin LvIA from Conus lividus that selectively blocks alpha 3 beta 2 vs. alpha 6/ alpha 3 beta 2 beta 3 nicotinic acetylcholine receptors. Faseb J., 28, 2014
4HWO	Crystal structure of E. coli Threonyl-tRNA synthetase bound to a novel inhibitor 分子名称: N-{[3-(4-aminoquinazolin-7-yl)phenyl]sulfonyl}-L-threoninamide, Threonine--tRNA ligase, ZINC ION 著者 Hilgers, M.T. 登録日 2012-11-08 公開日 2013-09-18 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.907 Å) 主引用文献 Identification of bacteria-selective threonyl-tRNA synthetase substrate inhibitors by structure-based design. J.Med.Chem., 56, 2013
3NQ2	Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R2 3/5G 分子名称: IMIDAZOLE, deoxyribose phosphate aldolase 著者 Khersonsky, O, Rothlisberge, D, Wollacott, A.M, Dym, O, Baker, D, Tawfik, D.S, Israel Structural Proteomics Center (ISPC) 登録日 2010-06-29 公開日 2011-02-09 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (2.02 Å) 主引用文献 Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution J.Mol.Biol., 407, 2011
3NR0	Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R6 6/10A 分子名称: deoxyribose phosphate aldolase 著者 Khersonsky, O, Rothlisberge, D, Wollacott, A.M, Dym, O, Baker, D, Tawfik, D.S, Israel Structural Proteomics Center (ISPC) 登録日 2010-06-30 公開日 2011-02-09 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution J.Mol.Biol., 407, 2011
4L9I	Bovine G Protein Coupled Receptor Kinase 1 in Complex with Paroxetine 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, Paroxetine, ... 著者 Homan, K.T, Tesmer, J.J.G. 登録日 2013-06-18 公開日 2014-01-22 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.32 Å) 主引用文献 Structural and functional analysis of g protein-coupled receptor kinase inhibition by paroxetine and a rationally designed analog. Mol.Pharmacol., 85, 2014
4HWR	Crystal structure of E. coli Threonyl-tRNA synthetase bound to a novel inhibitor 分子名称: N-{[3-(2H-indazol-5-yl)phenyl]sulfonyl}-L-threoninamide, Threonine--tRNA ligase, ZINC ION 著者 Hilgers, M.T. 登録日 2012-11-08 公開日 2013-09-18 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Identification of bacteria-selective threonyl-tRNA synthetase substrate inhibitors by structure-based design. J.Med.Chem., 56, 2013
6EIM	Human STK10 bound to GW683134A 分子名称: 1,2-ETHANEDIOL, Serine/threonine-protein kinase 10, ~{N}-[5-[4-[[2-fluoranyl-5-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-1~{H}-benzimidazol-2-yl]furan-2-carboxamide 著者 Sorrell, F.J, Berger, B.-T, Salah, E, von Delft, F, Bountra, C, Arrowsmith, C, Edwards, A.M, Knapp, S, Elkins, J.M. 登録日 2017-09-19 公開日 2017-11-01 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.43 Å) 主引用文献 Human STK10 bound to GW683134 To Be Published
6EJ1	Crystal structure of KDM5B in complex with KDOPZ48a. 分子名称: 1,2-ETHANEDIOL, 5-[1-[1-(2-chloranylethanoyl)piperidin-4-yl]pyrazol-4-yl]-7-oxidanylidene-6-propan-2-yl-4~{H}-pyrazolo[1,5-a]pyrimidine-3-carbonitrile, DIMETHYL SULFOXIDE, ... 著者 Srikannathasan, V, Newman, J.A, Szykowska, A, Wright, M, Ruda, G.F, Vazquez-Rodriguez, S.A, Kupinska, K, Strain-Damerell, C, Burgess-Brown, N.A, Arrowsmith, C.H, Edwards, A, Bountra, C, Oppermann, U, Huber, K, von Delft, F. 登録日 2017-09-19 公開日 2018-05-02 実験手法 X-RAY DIFFRACTION (2.07 Å) 主引用文献 Crystal structure of KDM5B in complex with KDOPZ48a. to be published
3NPX	Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution 分子名称: deoxyribose phosphate aldolase 著者 Khersonsky, O, Rothlisberge, D, Wollacott, A.M, Dym, O, Baker, D, Tawfik, D.S, Israel Structural Proteomics Center (ISPC) 登録日 2010-06-29 公開日 2011-02-09 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.79 Å) 主引用文献 Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution J.Mol.Biol., 407, 2011

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