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PDB: 492 件

3ZOA
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The structure of Trehalose Synthase (TreS) of Mycobacterium smegmatis in complex with acarbose
分子名称: 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, CALCIUM ION, CHLORIDE ION, ...
著者Caner, S, Nguyen, N, Aguda, A, Zhang, R, Pan, Y.T, Withers, S.G, Brayer, G.D.
登録日2013-02-21
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献The Structure of the Mycobacterium Smegmatis Trehalose Synthase Reveals an Unusual Active Site Configuration and Acarbose-Binding Mode.
Glycobiology, 23, 2013
4NLE
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Crystal structure of apo Adenylosuccinate Lyase from Mycobacterium smegmatis
分子名称: Adenylosuccinate lyase
著者Banerjee, S, Murthy, M.R.N.
登録日2013-11-14
公開日2014-03-05
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.16 Å)
主引用文献Structural and kinetic studies on adenylosuccinate lyase from Mycobacterium smegmatis and Mycobacterium tuberculosis provide new insights on the catalytic residues of the enzyme.
Febs J., 281, 2014
4AJM
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Development of a plate-based optical biosensor methodology to identify PDE10 fragment inhibitors
分子名称: 3-AMINO-6-FLUORO-2-[4-(2-METHYLPYRIDIN-4-YL)PHENYL]-N-(METHYLSULFONYL)QUINOLINE-4-CARBOXAMIDE, CAMP AND CAMP-INHIBITED CGMP 3', 5'-CYCLIC PHOSPHODIESTERASE 10A, ...
著者Geschwindner, S, Johansson, P, Spadola, L, Akerud, T, Back, E, Hillertz, P, Horsefeld, R, Scott, C, Spear, N, Tian, G, Tigerstrom, A, Aharony, D, Albert, J.S.
登録日2012-02-16
公開日2013-03-06
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Development of a Plate-Based Optical Biosensor Methodology to Identify Pde10 Fragment Inhibitors
To be Published
3ZO9
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BU of 3zo9 by Molmil
The structure of Trehalose Synthase (TreS) of Mycobacterium smegmatis
分子名称: CALCIUM ION, CHLORIDE ION, MAGNESIUM ION, ...
著者Caner, S, Nguyen, N, Aguda, A, Zhang, R, Pan, Y.T, Withers, S.G, Brayer, G.D.
登録日2013-02-21
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献The Structure of the Mycobacterium Smegmatis Trehalose Synthase Reveals an Unusual Active Site Configuration and Acarbose-Binding Mode.
Glycobiology, 23, 2013
4B1R
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BU of 4b1r by Molmil
Tetracycline repressor class D mutant H100A in complex with iso-7- Chlortetracycline
分子名称: CHLORIDE ION, ISO-7-CHLORTETRACYCLINE, TETRACYCLINE REPRESSOR PROTEIN CLASS D
著者Eltschkner, S, Palm, G.J, Schneider, J, Hinrichs, W.
登録日2012-07-12
公開日2013-07-24
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Tetracycline Repressor Class D Mutant H100A in Complex with Iso-7-Chlortetracycline
To be Published
4MTB
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BU of 4mtb by Molmil
Bovine trypsin in complex with small molecule inhibitor
分子名称: (2R)-2-amino-N-{(2S)-1-[(4-carbamimidoylbenzyl)amino]-1-oxopropan-2-yl}-4-(4-hydroxyphenyl)butanamide, CALCIUM ION, Cationic trypsin, ...
著者Wagner, S, Heine, A, Steinmetzer, T.
登録日2013-09-19
公開日2014-12-24
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.22 Å)
主引用文献X-ray structure of trypsin-inhibitor-complex
To be Published
4NSL
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BU of 4nsl by Molmil
X-ray Crystal structure of Adenylosuccinate Lyase from Salmonella typhimurium
分子名称: Adenylosuccinate lyase, PENTANE-1,5-DIAMINE
著者Banerjee, S, Agrawal, M.J, Murthy, M.R.N.
登録日2013-11-28
公開日2014-12-03
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Crystallographic and kinetic studies on Adenylosuccinate Lyase from Salmonella typhimurium
To be Published
2JQZ
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BU of 2jqz by Molmil
Solution Structure of the C2 domain of human Smurf2
分子名称: E3 ubiquitin-protein ligase SMURF2
著者Wiesner, S, Ogunjimi, A.A, Wang, H, Rotin, D, Sicheri, F, Wrana, J.L, Forman-Kay, J.D.
登録日2007-06-15
公開日2007-09-11
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Autoinhibition of the HECT-Type Ubiquitin Ligase Smurf2 through Its C2 Domain
Cell(Cambridge,Mass.), 130, 2007
2JCQ
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The hyaluronan binding domain of murine CD44 in a Type A complex with an HA 8-mer
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose, CD44 ANTIGEN, GLYCEROL
著者Banerji, S, Wright, A.J, Noble, M.E.M, Mahoney, D.J, Campbell, I.D, Day, A.J, Jackson, D.G.
登録日2007-01-03
公開日2007-01-30
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Structures of the Cd44-Hyaluronan Complex Provide Insight Into a Fundamental Carbohydrate-Protein Interaction.
Nat.Struct.Mol.Biol., 14, 2008
2JCP
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BU of 2jcp by Molmil
The hyaluronan binding domain of murine CD44
分子名称: CD44 ANTIGEN
著者Banerji, S, Wright, A.J, Noble, M.E.M, Mahoney, D.J, Campbell, I.D, Day, A.J, Jackson, D.G.
登録日2007-01-03
公開日2007-01-30
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structures of the Cd44-Hyaluronan Complex Provide Insight Into a Fundamental Carbohydrate-Protein Interaction.
Nat.Struct.Mol.Biol., 14, 2008
2K44
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BU of 2k44 by Molmil
Solution structure of a K+-channel voltage-sensor paddle domain
分子名称: K+-channel voltage-sensor paddle domain of Calcium-activated potassium channel subunit alpha-1
著者Unnerstale, S, Lind, J, Papadopoulos, E, Maler, L.
登録日2008-05-28
公開日2009-06-02
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Solution structure of the HsapBK K+-channel voltage-sensor paddle sequence
Biochemistry, 2009
2JCR
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BU of 2jcr by Molmil
The hyaluronan binding domain of murine CD44 in a Type B complex with an HA 8-mer
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose, CD44 ANTIGEN, GLYCEROL
著者Banerji, S, Wright, A.J, Noble, M.E.M, Mahoney, D.J, Campbell, I.D, Day, A.J, Jackson, D.G.
登録日2007-01-03
公開日2007-01-30
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structures of the Cd44-Hyaluronan Complex Provide Insight Into a Fundamental Carbohydrate-Protein Interaction.
Nat.Struct.Mol.Biol., 14, 2008
2L9G
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BU of 2l9g by Molmil
Solution structure of AS1p-Tar in 10% negatively charged bicelles
分子名称: Methyl-accepting chemotaxis protein II
著者Unnerstale, S, von Heijne, G, Draheim, R.R, Maler, L.
登録日2011-02-09
公開日2011-09-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structural characterization of AS1-membrane interactions from a subset of HAMP domains
Biochim.Biophys.Acta, 1808, 2011
6E5C
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BU of 6e5c by Molmil
Solution NMR structure of a de novo designed double-stranded beta-helix
分子名称: De novo beta protein
著者Marcos, E, Chidyausiku, T.M, McShan, A, Evangelidis, T, Nerli, S, Sgourakis, N, Tripsianes, K, Baker, D.
登録日2018-07-19
公開日2018-11-07
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献De novo design of a non-local beta-sheet protein with high stability and accuracy.
Nat. Struct. Mol. Biol., 25, 2018
5WOX
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BU of 5wox by Molmil
NMR solution structure of KanY protein (ms6282) using two 4D-spectra
分子名称: Uncharacterized protein
著者Evangelidis, T, Nerli, S, Sgourakis, N.G, Tripsianes, K.
登録日2017-08-03
公開日2018-02-07
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Automated NMR resonance assignments and structure determination using a minimal set of 4D spectra.
Nat Commun, 9, 2018
5WOZ
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BU of 5woz by Molmil
NMR solution structure of Rtt103 (RTT) protein using two 4D-spectra
分子名称: Regulator of Ty1 transposition protein 103
著者Evangelidis, T, Nerli, S, Sgourakis, N.G, Tripsianes, K.
登録日2017-08-03
公開日2018-02-07
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Automated NMR resonance assignments and structure determination using a minimal set of 4D spectra.
Nat Commun, 9, 2018
1HMA
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BU of 1hma by Molmil
THE SOLUTION STRUCTURE AND DYNAMICS OF THE DNA BINDING DOMAIN OF HMG-D FROM DROSOPHILA MELANOGASTER
分子名称: HMG-D
著者Jones, D.N.M, Searles, M.A, Shaw, G.L, Churchill, M.E.A, Ner, S.S, Keeler, J, Travers, A.A, Neuhaus, D.
登録日1994-05-12
公開日1994-07-31
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献The solution structure and dynamics of the DNA-binding domain of HMG-D from Drosophila melanogaster.
Structure, 2, 1994
7RY6
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BU of 7ry6 by Molmil
Solution NMR structural bundle of the first cyclization domain from yersiniabactin synthetase (Cy1) impacted by dynamics
分子名称: HMWP2 nonribosomal peptide synthetase
著者Kancherla, A.K, Mishra, S.H, Marincin, K.A, Nerli, S, Sgourakis, N.G, Dowling, D.P, Bouvignies, G, Frueh, D.P.
登録日2021-08-24
公開日2022-07-13
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Global protein dynamics as communication sensors in peptide synthetase domains.
Sci Adv, 8, 2022
4UIR
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BU of 4uir by Molmil
Structure of oleate hydratase from Elizabethkingia meningoseptica
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, HEXAETHYLENE GLYCOL, OLEATE HYDRATASE, ...
著者Pavkov-Keller, T, Hromic, A, Engleder, M, Emmerstorfer, A, Steinkellner, G, Schrempf, S, Wriessnegger, T, Leitner, E, Strohmeier, G.A, Kaluzna, I, Mink, D, Schuermann, M, Wallner, S, Macheroux, P, Pichler, H, Gruber, K.
登録日2015-04-02
公開日2015-07-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Structure-Based Mechanism of Oleate Hydratase from Elizabethkingia Meningoseptica.
Chembiochem, 16, 2015
6O0I
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BU of 6o0i by Molmil
NMR ensemble of computationally designed protein XAA
分子名称: Design construct XAA
著者Wei, K.Y, Moschidi, D, Nerli, S, Sgourakis, N, Baker, D.
登録日2019-02-16
公開日2020-04-22
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6O0C
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BU of 6o0c by Molmil
NMR ensemble of computationally designed protein XAA_GVDQ mutant M4L
分子名称: Design construct XAA_GVDQ mutant M4L
著者Wei, K.Y, Moschidi, D, Nerli, S, Sgourakis, N, Baker, D.
登録日2019-02-15
公開日2020-04-22
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
5WOT
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BU of 5wot by Molmil
NMR solution structure of a-lytic protease using two 4D-spectra
分子名称: Alpha-lytic protease
著者Evangelidis, T, Nerli, S, Sgourakis, N.G, Tripsianes, K.
登録日2017-08-03
公開日2018-02-07
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Automated NMR resonance assignments and structure determination using a minimal set of 4D spectra.
Nat Commun, 9, 2018
5WOY
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BU of 5woy by Molmil
NMR solution structure of Enzyme I (nEIt) protein using two 4D-spectra
分子名称: Phosphoenolpyruvate-protein phosphotransferase
著者Evangelidis, T, Nerli, S, Sgourakis, N.G, Tripsianes, K.
登録日2017-08-03
公開日2018-02-07
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Automated NMR resonance assignments and structure determination using a minimal set of 4D spectra.
Nat Commun, 9, 2018
6E6M
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Crystal structure of human cellular retinol-binding protein 1 in complex with cannabidiorcin (CBDO)
分子名称: (1'R,2'R)-4,5'-dimethyl-2'-(prop-1-en-2-yl)-1',2',3',4'-tetrahydro[1,1'-biphenyl]-2,6-diol, Retinol-binding protein 1
著者Silvaroli, J.A, Horwitz, S, Banerjee, S, Kiser, P.D, Golczak, M.
登録日2018-07-25
公開日2019-02-13
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Abnormal Cannabidiol Modulates Vitamin A Metabolism by Acting as a Competitive Inhibitor of CRBP1.
Acs Chem.Biol., 14, 2019
6OSW
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An order-to-disorder structural switch activates the FoxM1 transcription factor
分子名称: Forkhead box M1
著者Marceau, A.H, Rubin, S.M, Nerli, S, McShane, A.C, Sgourakis, N.G.
登録日2019-05-02
公開日2019-05-29
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献An order-to-disorder structural switch activates the FoxM1 transcription factor.
Elife, 8, 2019

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