3VQU | | CRYSTAL STRUCTURE OF HUMAN MPS1 CATALYTIC DOMAIN IN COMPLEX WITH 4-[(4-AMINO-5-CYANO-6-ETHOXYPYRIDIN-2- YL)AMINO]BENZAMIDE | | Descriptor: | Dual specificity protein kinase TTK, IODIDE ION, 4-[(4-amino-5-cyano-6-ethoxypyridin-2-yl)amino]benzamide | | Authors: | Kusakabe, K., Ide, N., Daigo, Y., Itoh, T., Higashino, K., Okano, Y., Tadano, G., Tachibana, Y., Sato, Y., Inoue, M., Wada, T., Iguchi, M., Kanazawa, T., Ishioka, Y., Dohi, K., Tagashira, S., Kido, Y., Sakamoto, S., Yasuo, K., Maeda, M., Yamamoto, T., Higaki, M., Endoh, T., Ueda, K., Shiota, T., Murai, H., Nakamura, Y. | | Deposit date: | 2012-03-30 | | Release date: | 2012-06-27 | | Method: | X-RAY DIFFRACTION (2.4 Å) | | Cite: | Diaminopyridine-Based Potent and Selective Mps1 Kinase Inhibitors Binding to an Unusual Flipped-Peptide Conformation
ACS MED.CHEM.LETT., 2012
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3W1F | | CRYSTAL STRUCTURE OF HUMAN MPS1 CATALYTIC DOMAIN IN COMPLEX WITH 5-(5-ETHOXY-6-(1-METHYL-1H-PYRAZOL-4-YL)-1H-INDAZOL-3-YL)-2-METHYLBENZENESULFONAMIDE | | Descriptor: | Dual specificity protein kinase TTK, 5-[5-ethoxy-6-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-3-yl]-2-methylbenzenesulfonamide | | Authors: | Kusakabe, K., Ide, N., Daigo, Y., Tachibana, Y., Itoh, T., Yamamoto, T., Hashizume, H., Hato, Y., Higashino, K., Okano, Y., Sato, Y., Inoue, M., Iguchi, M., Kanazawa, T., Ishioka, Y., Dohi, K., Kido, Y., Sakamoto, S., Yasuo, K., Maeda, M., Higaki, M., Ueda, K., Yoshizawa, H., Baba, Y., Shiota, T., Murai, H., Nakamura, Y. | | Deposit date: | 2012-11-14 | | Release date: | 2013-06-26 | | Last modified: | 2014-04-30 | | Method: | X-RAY DIFFRACTION (2.7 Å) | | Cite: | Indazole-based potent and cell-active Mps1 kinase inhibitors: rational design from pan-kinase inhibitor anthrapyrazolone (SP600125)
J.Med.Chem., 56, 2013
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3WMG | | CRYSTAL STRUCTURE OF AN INWARD-FACING EUKARYOTIC ABC MULTIDRUG TRANSPORTER G277V/A278V/A279V MUTANT IN COMPLEX WITH AN CYCLIC PEPTIDE INHIBITOR, ACAP | | Descriptor: | ATP-binding cassette, sub-family B, member 1, ... | | Authors: | Kodan, A., Yamaguchi, T., Nakatsu, T., Sakiyama, K., Hipolito, C.J., Fujioka, A., Hirokane, R., Ikeguchi, K., Watanabe, B., Hirtake, J., Kimura, Y., Suga, H., Ueda, K., Kato, H. | | Deposit date: | 2013-11-18 | | Release date: | 2014-04-30 | | Last modified: | 2017-11-22 | | Method: | X-RAY DIFFRACTION (2.4 Å) | | Cite: | Structural basis for gating mechanisms of a eukaryotic P-glycoprotein homolog.
Proc.Natl.Acad.Sci.USA, 111, 2014
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6GF0 | | LYSOZYME STRUCTURE DETERMINED FROM SFX DATA USING A SHEET-ON-SHEET CHIPLESS CHIP | | Descriptor: | Lysozyme C | | Authors: | Doak, R.B., Gorel, A., Foucar, L., Gruenbein, M.L., Hilpert, M., Kloos, M., Nass Kovacs, G., Roome, C., Shoeman, R.L., Stricker, M., Tono, K., You, D., Ueda, K., Sherrel, D., Owen, R., Barends, T.R.M., Schlichting, I. | | Deposit date: | 2018-04-27 | | Release date: | 2018-10-17 | | Last modified: | 2018-11-14 | | Method: | X-RAY DIFFRACTION (2.07 Å) | | Cite: | Crystallography on a chip - without the chip: sheet-on-sheet sandwich.
Acta Crystallogr D Struct Biol, 74, 2018
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6HAL | | HUMAN CARBONMONOXY HEMOGLOBIN SFX DATASET | | Descriptor: | Hemoglobin subunit alpha, Hemoglobin subunit beta, PROTOPORPHYRIN IX CONTAINING FE, ... | | Authors: | Doak, B., Gorel, A., Foucar, L., Barends, T.R.M., Gruenbein, M.L., Hilpert, M., Kloos, M., Nass Kovacs, G., Roome, C.M., Shoeman, R.L., Stricker, M., Tono, K., You, D., Ueda, K., Sherrell, D.A., Owen, R.L., Schlichting, I. | | Deposit date: | 2018-08-07 | | Release date: | 2018-10-17 | | Last modified: | 2018-11-14 | | Method: | X-RAY DIFFRACTION (2.2 Å) | | Cite: | Crystallography on a chip - without the chip: sheet-on-sheet sandwich.
Acta Crystallogr D Struct Biol, 74, 2018
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3WHP | | CRYSTAL STRUCTURE OF THE C-TERMINAL DOMAIN OF THEMUS THERMOPHILUS LITR IN COMPLEX WITH COBALAMIN | | Descriptor: | Probable transcriptional regulator, COBALAMIN | | Authors: | Agari, Y., Takano, H., Beppu, T., Ueda, K., Shinkai, A. | | Deposit date: | 2013-08-30 | | Release date: | 2014-09-03 | | Method: | X-RAY DIFFRACTION (2.52 Å) | | Cite: | Crystal structure of the C-terminal domain of Themus thermophilus LitR in complex with cobalamin
To be Published
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5OER | | HEN EGG-WHITE LYSOZYME REFINED AGAINST 5000 9 KEV DIFFRACTION PATTERNS | | Descriptor: | Lysozyme C, 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, GADOLINIUM ATOM, ... | | Authors: | Gorel, A., Schlichting, I. | | Deposit date: | 2017-07-09 | | Release date: | 2017-10-25 | | Last modified: | 2018-11-14 | | Method: | X-RAY DIFFRACTION (1.9 Å) | | Cite: | Multi-wavelength anomalous diffraction de novo phasing using a two-colour X-ray free-electron laser with wide tunability.
Nat Commun, 8, 2017
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3WME | | CRYSTAL STRUCTURE OF AN INWARD-FACING EUKARYOTIC ABC MULTIDRUG TRANSPORTER | | Descriptor: | ATP-binding cassette, sub-family B, member 1, ... | | Authors: | Kodan, A., Yamaguchi, T., Nakatsu, T., Kato, H. | | Deposit date: | 2013-11-18 | | Release date: | 2014-03-19 | | Last modified: | 2017-11-22 | | Method: | X-RAY DIFFRACTION (2.751 Å) | | Cite: | Structural basis for gating mechanisms of a eukaryotic P-glycoprotein homolog.
Proc.Natl.Acad.Sci.USA, 111, 2014
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3WMF | | CRYSTAL STRUCTURE OF AN INWARD-FACING EUKARYOTIC ABC MULTITRUG TRANSPORTER G277V/A278V/A279V MUTANT | | Descriptor: | ATP-binding cassette, sub-family B, member 1, ... | | Authors: | Kodan, A., Yamaguchi, T., Nakatsu, T., Kato, H. | | Deposit date: | 2013-11-18 | | Release date: | 2014-03-19 | | Last modified: | 2017-11-22 | | Method: | X-RAY DIFFRACTION (2.6 Å) | | Cite: | Structural basis for gating mechanisms of a eukaryotic P-glycoprotein homolog.
Proc.Natl.Acad.Sci.USA, 2014
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6A1F | | CRYSTAL STRUCTURE OF HUMAN DYRK1A IN COMPLEX WITH COMPOUND 14 | | Descriptor: | Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, 8-methoxy-5,5-dimethyl-5,6-dihydrobenzo[h]quinazolin-4-amine, ... | | Authors: | Baba, D., Hanzawa, H. | | Deposit date: | 2018-06-07 | | Release date: | 2018-10-03 | | Last modified: | 2018-10-24 | | Method: | X-RAY DIFFRACTION (1.5 Å) | | Cite: | Discovery of DS42450411 as a potent orally active hepcidin production inhibitor: Design and optimization of novel 4-aminopyrimidine derivatives.
Bioorg. Med. Chem. Lett., 28, 2018
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6A1G | | CRYSTAL STRUCTURE OF HUMAN DYRK1A IN COMPLEX WITH COMPOUND 32 | | Descriptor: | Dual specificity tyrosine-phosphorylation-regulated kinase 1A, 5,5-dimethyl-8-[1-(piperidin-4-yl)ethenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine | | Authors: | Baba, D., Hanzawa, H. | | Deposit date: | 2018-06-07 | | Release date: | 2018-10-03 | | Last modified: | 2018-10-24 | | Method: | X-RAY DIFFRACTION (2.15 Å) | | Cite: | Discovery of DS42450411 as a potent orally active hepcidin production inhibitor: Design and optimization of novel 4-aminopyrimidine derivatives.
Bioorg. Med. Chem. Lett., 28, 2018
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6A6M | | CRYSTAL STRUCTURE OF AN OUTWARD-OPEN NUCLEOTIDE-BOUND STATE OF THE EUKARYOTIC ABC MULTIDRUG TRANSPORTER CMABCB1 | | Descriptor: | ATP-binding cassette, sub-family B, member 1, ... | | Authors: | Kato, H., Nakatsu, T., Kodan, A. | | Deposit date: | 2018-06-28 | | Release date: | 2019-02-20 | | Method: | X-RAY DIFFRACTION (1.9 Å) | | Cite: | Inward- and outward-facing X-ray crystal structures of homodimeric P-glycoprotein CmABCB1.
Nat Commun, 10, 2019
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6A6N | | CRYSTAL STRUCTURE OF AN INWARD-OPEN APO STATE OF THE EUKARYOTIC ABC MULTIDRUG TRANSPORTER CMABCB1 | | Descriptor: | ATP-binding cassette, sub-family B, member 1, ... | | Authors: | Kato, H., Nakatsu, T., Kodan, A. | | Deposit date: | 2018-06-28 | | Release date: | 2019-01-16 | | Last modified: | 2019-01-23 | | Method: | X-RAY DIFFRACTION (3.02 Å) | | Cite: | Inward- and outward-facing X-ray crystal structures of homodimeric P-glycoprotein CmABCB1.
Nat Commun, 10, 2019
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6JMF | |
1QTO | | 1.5 A CRYSTAL STRUCTURE OF A BLEOMYCIN RESISTANCE DETERMINANT FROM BLEOMYCIN-PRODUCING STREPTOMYCES VERTICILLUS | | Descriptor: | BLEOMYCIN-BINDING PROTEIN | | Authors: | Kawano, Y., Kumagai, T., Muta, K., Matoba, Y., Davies, J., Sugiyama, M. | | Deposit date: | 1999-06-28 | | Release date: | 2000-06-28 | | Last modified: | 2017-10-04 | | Method: | X-RAY DIFFRACTION (1.5 Å) | | Cite: | The 1.5 A crystal structure of a bleomycin resistance determinant from bleomycin-producing Streptomyces verticillus.
J.Mol.Biol., 295, 2000
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