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2M97
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BU of 2m97 by Molmil
Optimized Ratiometric Calcium Sensors For Functional In Vivo Imaging of Neurons and T-Lymphocytes
Descriptor: Optimized Ratiometric Calcium Sensor
Authors:Russo, L, Becker, S, Griesinger, C.
Deposit date:2013-06-04
Release date:2014-01-01
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Optimized ratiometric calcium sensors for functional in vivo imaging of neurons and T lymphocytes.
Nat.Methods, 11, 2014
2KOX
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BU of 2kox by Molmil
NMR residual dipolar couplings identify long range correlated motions in the backbone of the protein ubiquitin
Descriptor: Ubiquitin
Authors:Fenwick, R.B, Richter, B, Lee, D, Walter, K.F.A, Milovanovic, D, Becker, S, Lakomek, N.A, Griesinger, C, Salvatella, X.
Deposit date:2009-10-02
Release date:2011-06-08
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Weak Long-Range Correlated Motions in a Surface Patch of Ubiquitin Involved in Molecular Recognition
J.Am.Chem.Soc., 2011
2J80
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BU of 2j80 by Molmil
Structure of Citrate-bound Periplasmic Domain of Sensor Histidine Kinase CitA
Descriptor: CITRATE ANION, GLYCEROL, SENSOR KINASE CITA, ...
Authors:Sevvana, M, Vijayan, V, Zweckstetter, M, Reinelt, S, Madden, D.R, Sheldrick, G.M, Bott, M, Griesinger, C, Becker, S.
Deposit date:2006-10-18
Release date:2007-10-23
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:A Ligand-Induced Switch in the Periplasmic Domain of Sensor Histidine Kinase Cita.
J.Mol.Biol., 377, 2008
2KDU
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BU of 2kdu by Molmil
Structural basis of the Munc13-1/Ca2+-Calmodulin interaction: A novel 1-26 calmodulin binding motif with a bipartite binding mode
Descriptor: CALCIUM ION, Calmodulin, Protein unc-13 homolog A
Authors:Rodriguez-Castaneda, F.A, Maestre-Martinez, M, Coudevylle, N, Dimova, K, Jahn, O, Junge, H, Becker, S, Brose, N, Carlomagno, T, Griesinger, C.
Deposit date:2009-01-19
Release date:2009-12-15
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Modular architecture of Munc13/calmodulin complexes: dual regulation by Ca2+ and possible function in short-term synaptic plasticity.
Embo J., 29, 2010
2MWH
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BU of 2mwh by Molmil
NMR solution structure of ligand-free OAA
Descriptor: Anti-HIV lectin OAA
Authors:Lee, D, Carneiro, M.G, Koharudin, L.M, Griesinger, C, Gronenborn, A.M, Ban, D, Sabo, T, Trigo-Mourino, P, Mazur, A.
Deposit date:2014-11-10
Release date:2015-04-22
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Sampling of Glycan-Bound Conformers by the Anti-HIV Lectin Oscillatoria agardhii agglutinin in the Absence of Sugar.
Angew.Chem.Int.Ed.Engl., 54, 2015
1X6M
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BU of 1x6m by Molmil
Crystal structure of the glutathione-dependent formaldehyde-activating enzyme (Gfa)
Descriptor: GLYCEROL, Glutathione-dependent formaldehyde-activating enzyme, SULFATE ION, ...
Authors:Neculai, A.M, Neculai, D, Vorholt, J.A, Becker, S.
Deposit date:2004-08-11
Release date:2004-11-23
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:A dynamic zinc redox switch
J.Biol.Chem., 280, 2005
7OOJ
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BU of 7ooj by Molmil
Structure of D-Thr53 Ubiquitin
Descriptor: CADMIUM ION, Ubiquitin
Authors:Becker, S.
Deposit date:2021-05-27
Release date:2022-05-18
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:A litmus test for classifying recognition mechanisms of transiently binding proteins.
Nat Commun, 13, 2022
7QI2
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BU of 7qi2 by Molmil
Magic-angle spinning NMR structure of the human voltage-dependent anion channel 1 (E73V/C127A/C232S) in DMPC lipid bilayers
Descriptor: Voltage-dependent anion-selective channel protein 1
Authors:Najbauer, E.E, Andreas, L.B.
Deposit date:2021-12-14
Release date:2022-03-16
Last modified:2024-06-19
Method:SOLID-STATE NMR
Cite:Structure and Gating Behavior of the Human Integral Membrane Protein VDAC1 in a Lipid Bilayer.
J.Am.Chem.Soc., 144, 2022
5FQ1
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BU of 5fq1 by Molmil
Structure of the cytoplasmic PAS domain of the Geobacillus thermodenitrificans histidine kinase CitA
Descriptor: GLYCEROL, HISTIDINE KINASE, PHOSPHATE ION
Authors:Schomburg, B, Giller, K, Becker, S.
Deposit date:2015-12-03
Release date:2017-01-11
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Cryogenic optical localization provides 3D protein structure data with Angstrom resolution.
Nat. Methods, 14, 2017
1HXV
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BU of 1hxv by Molmil
PPIASE DOMAIN OF THE MYCOPLASMA GENITALIUM TRIGGER FACTOR
Descriptor: TRIGGER FACTOR
Authors:Vogtherr, M, Parac, T.N, Maurer, M, Pahl, A, Fiebig, K.
Deposit date:2001-01-17
Release date:2002-05-29
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:NMR solution structure and dynamics of the peptidyl-prolyl cis-trans isomerase domain of the trigger factor from Mycoplasma genitalium compared to FK506-binding protein.
J.Mol.Biol., 318, 2002
3DND
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BU of 3dnd by Molmil
cAMP-dependent protein kinase PKA catalytic subunit with PKI-5-24
Descriptor: 5-benzyl-1,3-thiazol-2-amine, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha
Authors:Schiffer, A, Wendt, K.U.
Deposit date:2008-07-02
Release date:2009-06-23
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Crystallography-independent determination of ligand binding modes
Angew.Chem.Int.Ed.Engl., 47, 2008
3DNE
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BU of 3dne by Molmil
cAMP-dependent protein kinase PKA catalytic subunit with PKI-5-24
Descriptor: 3-pyridin-4-yl-1H-indazole, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha
Authors:Schiffer, A, Wendt, K.U.
Deposit date:2008-07-02
Release date:2009-06-23
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystallography-independent determination of ligand binding modes
Angew.Chem.Int.Ed.Engl., 47, 2008
2KUZ
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BU of 2kuz by Molmil
2-Aminopurine incorporation perturbs the dynamics and structure of DNA
Descriptor: DNA (5'-D(*CP*GP*AP*CP*GP*TP*TP*TP*GP*CP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*GP*CP*AP*AP*AP*CP*GP*TP*CP*G)-3')
Authors:Dallmann, A, Dehmel, L, Peters, T, Muegge, C, Griesinger, C.P, Tuma, J, Ernsting, N.P.
Deposit date:2010-03-03
Release date:2010-07-28
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:2-aminopurine incorporation perturbs the dynamics and structure of DNA.
Angew.Chem.Int.Ed.Engl., 49, 2010
2KV0
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BU of 2kv0 by Molmil
2-Aminopurine incorporation perturbs the dynamics and structure of DNA
Descriptor: DNA (5'-D(*CP*GP*AP*CP*GP*TP*TP*TP*GP*CP*AP*GP*C)-3'), DNA (5'-D(*GP*CP*TP*GP*CP*AP*(2PR)P*AP*CP*GP*TP*CP*G)-3')
Authors:Dallmann, A, Dehmel, L, Peters, T, Muegge, C, Griesinger, C.P, Tuma, J, Ernsting, N.P.
Deposit date:2010-03-03
Release date:2011-01-19
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:2-Aminopurine incorporation perturbs the dynamics and structure of DNA.
Angew.Chem.Int.Ed.Engl., 49, 2010
9EYH
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BU of 9eyh by Molmil
Ubiquitin conjugating enzyme Ubc6 UBC domain with isopeptide-linked ubiquitin
Descriptor: Ubiquitin-40S ribosomal protein S31, Ubiquitin-conjugating enzyme E2 6
Authors:Swarnkar, A, Stein, A.
Deposit date:2024-04-09
Release date:2024-11-20
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Determinants of chemoselectivity in ubiquitination by the J2 family of ubiquitin-conjugating enzymes.
Embo J., 43, 2024
9EWP
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BU of 9ewp by Molmil
Crystal structure of yeast E2 Ubiquitin-conjugating enzyme Ubc6 UBC domain
Descriptor: 1,2-ETHANEDIOL, CADMIUM ION, CHLORIDE ION, ...
Authors:Swarnkar, A, Stein, A.
Deposit date:2024-04-04
Release date:2024-11-20
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (1.21 Å)
Cite:Determinants of chemoselectivity in ubiquitination by the J2 family of ubiquitin-conjugating enzymes.
Embo J., 43, 2024
9EN5
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BU of 9en5 by Molmil
Crystal structure of yeast E2 Ubiquitin-conjugating enzyme Ubc6 UBC domain
Descriptor: Ubiquitin-conjugating enzyme E2 6
Authors:Swarnkar, A, Stein, A.
Deposit date:2024-03-12
Release date:2024-11-20
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (1.33 Å)
Cite:Determinants of chemoselectivity in ubiquitination by the J2 family of ubiquitin-conjugating enzymes.
Embo J., 43, 2024
8BGB
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BU of 8bgb by Molmil
Structure of the citrate-bound extracytoplasmic PAS domain of histidine kinase CitA from Geobacillus thermodenitrificans
Descriptor: CITRATE ANION, Histidine kinase, SODIUM ION
Authors:Becker, S.
Deposit date:2022-10-27
Release date:2023-11-08
Last modified:2025-05-21
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Mechanism of sensor kinase CitA transmembrane signaling.
Nat Commun, 16, 2025
8BJP
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BU of 8bjp by Molmil
The N288D mutant cytoplasmic PAS domain of Geobacillus thermodenitrificans histidine kinase CitA
Descriptor: MAGNESIUM ION, cytoplasmic PAS domain of CitA from Geobacillus thermodenitrificans
Authors:Becker, S.
Deposit date:2022-11-04
Release date:2023-11-15
Last modified:2025-05-21
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Mechanism of sensor kinase CitA transmembrane signaling.
Nat Commun, 16, 2025
8BIY
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BU of 8biy by Molmil
Citrate-free extracytoplasmic PAS domain mutant R93A of sensor histidine kinase CitA from Geobacillus thermodenitrificans
Descriptor: 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID, GLYCEROL, Histidine kinase, ...
Authors:Becker, S.
Deposit date:2022-11-02
Release date:2023-11-15
Last modified:2025-05-21
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Mechanism of sensor kinase CitA transmembrane signaling.
Nat Commun, 16, 2025
4YXS
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BU of 4yxs by Molmil
CAMP-DEPENDENT PROTEIN KINASE PKA CATALYTIC SUBUNIT WITH PKI-5-24
Descriptor: N-BENZYL-9H-PURIN-6-AMINE, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha
Authors:Schiffer, A, Wendt, K.U.
Deposit date:2015-03-23
Release date:2015-05-20
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:A combination of spin diffusion methods for the determination of protein-ligand complex structural ensembles.
Angew.Chem.Int.Ed.Engl., 54, 2015
4YXR
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BU of 4yxr by Molmil
CRYSTAL STRUCTURE OF PKA IN COMPLEX WITH inhibitor.
Descriptor: 3-methyl-2H-indazole, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha
Authors:Schiffer, A, Wendt, K.U.
Deposit date:2015-03-23
Release date:2015-05-27
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:A combination of spin diffusion methods for the determination of protein-ligand complex structural ensembles.
Angew.Chem.Int.Ed.Engl., 54, 2015
1YGW
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BU of 1ygw by Molmil
NMR STRUCTURE OF RIBONUCLEASE T1, 34 STRUCTURES
Descriptor: RIBONUCLEASE T1
Authors:Pfeiffer, S, Karimi-Nejad, Y, Ruterjans, H.
Deposit date:1996-09-28
Release date:1997-10-08
Last modified:2024-11-20
Method:SOLUTION NMR
Cite:Limits of NMR structure determination using variable target function calculations: ribonuclease T1, a case study.
J.Mol.Biol., 266, 1997
2LEV
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BU of 2lev by Molmil
Structure of the DNA complex of the C-Terminal domain of Ler
Descriptor: DNA (5'-D(*CP*CP*TP*AP*TP*CP*AP*AP*TP*TP*AP*TP*CP*GP*C)-3'), DNA (5'-D(*GP*CP*GP*AP*TP*AP*AP*TP*TP*GP*AP*TP*AP*GP*G)-3'), Ler
Authors:Cordeiro, T.N, Schimdt, H, Madrid, C, Juarez, A, Bernado, P, Grisienger, C, Garcia, J, Pons, M.
Deposit date:2011-06-23
Release date:2011-12-07
Last modified:2024-05-01
Method:SOLUTION NMR, SOLUTION SCATTERING
Cite:Indirect DNA Readout by an H-NS Related Protein: Structure of the DNA Complex of the C-Terminal Domain of Ler.
Plos Pathog., 7, 2011
2LGC
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BU of 2lgc by Molmil
Joint NMR and X-ray refinement reveals the structure of a novel dibenzo[a,d]cycloheptenone inhibitor/p38 MAP kinase complex in solution
Descriptor: Mitogen-activated protein kinase 14
Authors:Habeck, M.
Deposit date:2011-07-25
Release date:2012-07-25
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Inferential NMR/X-ray-based structure determination of a dibenzo[a,d]cycloheptenone inhibitor-p38alpha MAP kinase complex in solution
Angew.Chem.Int.Ed.Engl., 51, 2012

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