PDB: 192 resultsInfo pagesStatus searchChemie searchBIRD

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1PSR	HUMAN PSORIASIN (S100A7) Descriptor: HOLMIUM ATOM, PSORIASIN Authors: Brodersen, D.E, Etzerodt, M, Madsen, P, Celis, J, Thoegersen, H.C, Nyborg, J, Kjeldgaard, M. Deposit date: 1997-11-27 Release date: 1999-01-13 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (1.05 Å) Cite: EF-hands at atomic resolution: the structure of human psoriasin (S100A7) solved by MAD phasing. Structure, 6, 1998
4PE0	Crystal Structure of Calcium-loaded S100B bound to SBi4434 Descriptor: 2-[(2-hydroxyethyl)sulfanyl]naphthalene-1,4-dione, CALCIUM ION, Protein S100-B Authors: Cavalier, M.C, Pierce, P.D, Wilder, P.T, Neau, D, Toth, E.A, Weber, D.J. Deposit date: 2014-04-22 Release date: 2014-11-05 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.08 Å) Cite: Covalent Small Molecule Inhibitors of Ca(2+)-Bound S100B. Biochemistry, 53, 2014
1K8U	CRYSTAL STRUCTURE OF CALCIUM-FREE (OR APO) HUMAN S100A6; CYS3MET MUTANT (SELENOMETHIONINE DERIVATIVE) Descriptor: S100A6 Authors: Otterbein, L.R, Dominguez, R. Deposit date: 2001-10-25 Release date: 2002-04-10 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (1.15 Å) Cite: Crystal structures of S100A6 in the Ca(2+)-free and Ca(2+)-bound states: the calcium sensor mechanism of S100 proteins revealed at atomic resolution. Structure, 10, 2002
3RM1	1.24 Angstrom X-ray structure of bovine TRTK12-Ca(2+)-S100B D63N Descriptor: CALCIUM ION, F-actin-capping protein subunit alpha-2, Protein S100-B Authors: Liriano, M.A, Weber, D.J. Deposit date: 2011-04-20 Release date: 2012-04-25 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.24 Å) Cite: The effects of CapZ peptide (TRTK12) on the protein dynamics of S100B and S100B D63N To be Published
6WN7	Homo sapiens S100A5 Descriptor: CALCIUM ION, Protein S100-A5 Authors: Perkins, A, Harms, M.J, Wong, C.E, Wheeler, L.C. Deposit date: 2020-04-22 Release date: 2020-09-30 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Learning peptide recognition rules for a low-specificity protein. Protein Sci., 29, 2020
5ER5	Crystal Structure of Calcium-loaded S100B bound to SC1990 Descriptor: CALCIUM ION, ETHIDIUM, Protein S100-B Authors: Cavalier, M.C, Melville, Z.E, Aligholizadeh, E, Fang, L, Alasady, M.J, Pierce, A.D, Wilder, P.T, MacKerell Jr, A.D, Weber, D.J. Deposit date: 2015-11-13 Release date: 2016-06-08 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.26 Å) Cite: Novel protein-inhibitor interactions in site 3 of Ca(2+)-bound S100B as discovered by X-ray crystallography. Acta Crystallogr D Struct Biol, 72, 2016
5D7F	X-ray structure of Ca(2+)-S100B with human RAGE-derived W72 peptide Descriptor: Advanced glycosylation end product-specific receptor, CALCIUM ION, GLYCEROL, ... Authors: Jensen, J.L, Colbert, C.L. Deposit date: 2015-08-13 Release date: 2016-08-17 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.3 Å) Cite: X-ray structure of Ca(2+)-S100B with human RAGE-derived W72 peptide To Be Published
4DUQ	The Structure of Ca2+-loaded S100A2 at 1.3A resolution Descriptor: CALCIUM ION, POLYETHYLENE GLYCOL (N=34), Protein S100-A2 Authors: Koch, M, Fritz, G. Deposit date: 2012-02-22 Release date: 2012-03-07 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.3 Å) Cite: The structure of Ca2+-loaded S100A2 at 1.3- angstrom resolution. Febs J., 279, 2012
4CFQ	Ca-bound truncated (delta13C) and C3S, C81S and C86S mutated S100A4 complexed with non-muscle myosin IIA Descriptor: CALCIUM ION, MYOSIN-9, PROTEIN S100-A4 Authors: Duelli, A, Kiss, B, Lundholm, I, Bodor, A, Radnai, L, Petoukhov, M, Svergun, D, Nyitray, L, Katona, G. Deposit date: 2013-11-19 Release date: 2014-05-07 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.37 Å) Cite: The C-Terminal Random Coil Region Tunes the Ca2+-Binding Affinity of S100A4 Through Conformational Activation. Plos One, 9, 2014
4CFR	Ca-bound S100A4 C3S, C81S, C86S and F45W mutant complexed with non- muscle myosin IIA Descriptor: CALCIUM ION, MYOSIN-9, PROTEIN S100-A4 Authors: Duelli, A, Kiss, B, Lundholm, I, Bodor, A, Radnai, L, Petoukhov, M, Svergun, D, Nyitray, L, Katona, G. Deposit date: 2013-11-19 Release date: 2014-05-07 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (1.4 Å) Cite: The C-Terminal Random Coil Region Tunes the Ca2+-Binding Affinity of S100A4 Through Conformational Activation. Plos One, 9, 2014
3CZT	Crystal Structure of S100B in the Calcium and Zinc Loaded State at pH 9 Descriptor: CALCIUM ION, Protein S100-B, ZINC ION Authors: Ostendorp, T, Diez, J, Heizmann, C.W, Fritz, G. Deposit date: 2008-04-30 Release date: 2009-04-14 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.4 Å) Cite: The crystal structures of human S100B in the zinc- and calcium-loaded state at three pH values reveal zinc ligand swapping. Biochim.Biophys.Acta, 1813, 2011
1K96	CRYSTAL STRUCTURE OF CALCIUM BOUND HUMAN S100A6 Descriptor: BETA-MERCAPTOETHANOL, CALCIUM ION, S100A6 Authors: Otterbein, L.R, Dominguez, R. Deposit date: 2001-10-26 Release date: 2002-04-10 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (1.44 Å) Cite: Crystal structures of S100A6 in the Ca(2+)-free and Ca(2+)-bound states: the calcium sensor mechanism of S100 proteins revealed at atomic resolution. Structure, 10, 2002
1QX2	X-ray Structure of Calcium-loaded Calbindomodulin (A Calbindin D9k Re-engineered to Undergo a Conformational Opening) at 1.44 A Resolution Descriptor: CALCIUM ION, Vitamin D-dependent calcium-binding protein, intestinal, ... Authors: Bunick, C.G, Nelson, M.R, Mangahas, S, Mizoue, L.S, Bunick, G.J, Chazin, W.J. Deposit date: 2003-09-04 Release date: 2004-05-25 Last modified: 2021-10-27 Method: X-RAY DIFFRACTION (1.44 Å) Cite: Designing Sequence to Control Protein Function in an EF-Hand Protein J.Am.Chem.Soc., 126, 2004
6ZDY	Crystal structure of WT murine S100A9 bound to calcium and zinc Descriptor: CALCIUM ION, Protein S100-A9, SULFATE ION, ... Authors: Yatime, L. Deposit date: 2020-06-15 Release date: 2021-01-13 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Divalent cations influence the dimerization mode of murine S100A9 protein by modulating its disulfide bond pattern. J.Struct.Biol., 213, 2020
3NSO	Crystal Structure of S100A3 Protein Expressed in Insect Cell Descriptor: Protein S100-A3 Authors: Unno, M, Takahara, H, Kizawa, K. Deposit date: 2010-07-02 Release date: 2011-03-16 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Refined crystal structures of human Ca(2+)/Zn(2+)-binding S100A3 protein characterized by two disulfide bridges J.Mol.Biol., 408, 2011
3C1V	The 1.5 A Crystal structure of Ca2+-bound S100A4 Descriptor: CALCIUM ION, Protein S100-A4 Authors: Gingras, A.R, Barsukov, I.L. Deposit date: 2008-01-24 Release date: 2008-04-01 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Crystal structure of the Ca(2+)-form and Ca(2+)-binding kinetics of metastasis-associated protein, S100A4 Febs Lett., 582, 2008
1IG5	BOVINE CALBINDIN D9K BINDING MG2+ Descriptor: MAGNESIUM ION, VITAMIN D-DEPENDENT CALCIUM-BINDING PROTEIN, INTESTINAL Authors: Andersson, E.M, Svensson, L.A. Deposit date: 2001-04-17 Release date: 2001-04-25 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structural basis for the negative allostery between Ca(2+)- and Mg(2+)-binding in the intracellular Ca(2+)-receptor calbindin D9k. Protein Sci., 6, 1997
3NSL	Crystal Structure of S100A3 C30A+C68A double mutant expressed in insect cell Descriptor: GLYCEROL, Protein S100-A3 Authors: Unno, M, Takahara, H, Kizawa, K. Deposit date: 2010-07-02 Release date: 2011-03-16 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Refined crystal structures of human Ca(2+)/Zn(2+)-binding S100A3 protein characterized by two disulfide bridges J.Mol.Biol., 408, 2011
3D0Y	Crystal Structure of S100B in the Calcium and Zinc Loaded State at pH 6.5 Descriptor: CALCIUM ION, Protein S100-B, TETRAETHYLENE GLYCOL, ... Authors: Ostendorp, T, Diez, J, Heizmann, C.W, Fritz, G. Deposit date: 2008-05-02 Release date: 2009-04-14 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.5 Å) Cite: The crystal structures of human S100B in the zinc- and calcium-loaded state at three pH values reveal zinc ligand swapping. Biochim.Biophys.Acta, 1813, 2011
3IQO	1.5 angstrom X-ray structure of bovine Ca(2+)-S100B Descriptor: CALCIUM ION, Protein S100-B Authors: Charpentier, T.H, Weber, D.J, Toth, E.A. Deposit date: 2009-08-20 Release date: 2010-02-02 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.5 Å) Cite: The Effects of CapZ Peptide (TRTK-12) Binding to S100B-Ca(2+) as Examined by NMR and X-ray Crystallography J.Mol.Biol., 396, 2010
5DKN	Crystal Structure of Calcium-loaded S100B bound to SBi4225 Descriptor: 2,2'-[heptane-1,7-diylbis(oxybenzene-4,1-diyl)]bis(1H-imidazole), CALCIUM ION, Protein S100-B Authors: Cavalier, M.C, Ansari, M.I, Pierce, A.D, Wilder, P.T, McKnight, L.E, Raman, E.P, Neau, D.B, Bezawada, P, Alasady, M.J, Varney, K.M, Toth, E.A, MacKerell Jr, A.D, Coop, A, Weber, D.J. Deposit date: 2015-09-03 Release date: 2016-01-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.528 Å) Cite: Small Molecule Inhibitors of Ca(2+)-S100B Reveal Two Protein Conformations. J.Med.Chem., 59, 2016
4ETO	Structure of S100A4 in complex with non-muscle myosin-IIA peptide Descriptor: CALCIUM ION, Myosin-9, Protein S100-A4 Authors: Ramagopal, U.A, Dulyaninova, N.G, Kumar, P.R, Almo, S.C, Bresnick, A.R, New York Structural Genomics Research Consortium (NYSGRC), Atoms-to-Animals: The Immune Function Network (IFN) Deposit date: 2012-04-24 Release date: 2012-07-11 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.54 Å) Cite: Structure of S100A4 with bound peptide P To be Published
3NSK	Crystal Structure of the Post-Refolded S100A3 R51A Mutant Expressed in Insect Cell Descriptor: Protein S100-A3 Authors: Unno, M, Takahara, H, Kizawa, K. Deposit date: 2010-07-01 Release date: 2011-03-16 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Refined crystal structures of human Ca(2+)/Zn(2+)-binding S100A3 protein characterized by two disulfide bridges J.Mol.Biol., 408, 2011
4PE1	Crystal Structure of Calcium-loaded S100B bound to SC124 Descriptor: CALCIUM ION, DIETHYLCARBAMODITHIOIC ACID, Protein S100-B Authors: Cavalier, M.C, Pierce, A.D, Wilder, P.T, Neau, D, Toth, E.A, Weber, D.J. Deposit date: 2014-04-22 Release date: 2014-10-15 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.576 Å) Cite: Covalent Small Molecule Inhibitors of Ca(2+)-Bound S100B. Biochemistry, 53, 2014
5DKQ	Crystal Structure of Calcium-loaded S100B bound to SBi4214 Descriptor: 2,2'-[pentane-1,5-diylbis(oxybenzene-4,1-diyl)]di-1,4,5,6-tetrahydropyrimidine, CALCIUM ION, Protein S100-B Authors: Cavalier, M.C, Ansari, M.I, Pierce, A.D, Wilder, P.T, McKnight, L.E, Raman, E.P, Neau, D.B, Bezawada, P, Alasady, M.J, Varney, K.M, Toth, E.A, MacKerell Jr, A.D, Coop, A, Weber, D.J. Deposit date: 2015-09-03 Release date: 2016-01-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.591 Å) Cite: Small Molecule Inhibitors of Ca(2+)-S100B Reveal Two Protein Conformations. J.Med.Chem., 59, 2016

 

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