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4ATI
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BU of 4ati by Molmil
MITF:M-box complex
Descriptor: 5'-D(*AP*GP*GP*GP*TP*CP*AP*TP*GP*TP*GP*CP*TP*AP*AP*C)-3', 5'-D(*GP*TP*TP*AP*GP*CP*AP*CP*AP*TP*GP*AP*CP*CP*CP*T)-3', MICROPHTHALMIA-ASSOCIATED TRANSCRIPTION FACTOR
Authors:Pogenberg, V, Deineko, V, Wilmanns, M.
Deposit date:2012-05-08
Release date:2012-12-12
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Restricted Leucine Zipper Dimerization and Specificity of DNA Recognition of the Melanocyte Master Regulator Mitf
Genes Dev., 26, 2012
4DLZ
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BU of 4dlz by Molmil
H-Ras Set 2 Ca(OAc)2/DTE, ordered off
Descriptor: (2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, CALCIUM ION, GTPase HRas, ...
Authors:Holzapfel, G, Mattos, C.
Deposit date:2012-02-06
Release date:2012-08-08
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.662 Å)
Cite:Shift in the Equilibrium between On and Off States of the Allosteric Switch in Ras-GppNHp Affected by Small Molecules and Bulk Solvent Composition.
Biochemistry, 51, 2012
4DC8
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BU of 4dc8 by Molmil
Crystal Structure of Myoglobin Unexposed to Excessive SONICC Imaging Laser Dose.
Descriptor: Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
Authors:Becker, M, Mulichak, A.M, Kissick, D.J, Fischetti, R.F, Keefe, L.J, Simpson, D.J.
Deposit date:2012-01-17
Release date:2013-01-23
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Towards protein-crystal centering using second-harmonic generation (SHG) microscopy.
Acta Crystallogr.,Sect.D, 69, 2013
4DCF
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BU of 4dcf by Molmil
Structure of MTX-II from Bothrops brazili
Descriptor: MTX-II chain A, TETRAETHYLENE GLYCOL
Authors:Ullah, A, Souza, T.A.C.B, Betzel, C, Murakami, M.T, Arni, R.K.
Deposit date:2012-01-17
Release date:2012-06-13
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystallographic portrayal of different conformational states of a Lys49 phospholipase A2 homologue: insights into structural determinants for myotoxicity and dimeric configuration.
Int.J.Biol.Macromol., 51, 2012
4B49
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BU of 4b49 by Molmil
1.15 A Structure of Lysozyme Crystallized without 2-methyl-2,4- pentanediol
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, LYSOZYME C
Authors:Jakoncic, J, Berger, J, Stauber, M, Axelbaum, A, Asherie, N.
Deposit date:2012-07-28
Release date:2012-08-22
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Crystallization of Lysozyme with (R)-, (S)- and (Rs)-2-Methyl-2,4-Pentanediol
Acta Crystallogr.,Sect.D, 71, 2015
4DD3
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BU of 4dd3 by Molmil
EVAL processed HEWL, carboplatin aqueous paratone
Descriptor: 2-methylprop-1-ene, CHLORIDE ION, Lysozyme C
Authors:Tanley, S.W, Schreurs, A.M, Kroon-Batenburg, L.M, Meredith, J, Prendergast, R, Walsh, D, Bryant, P, Levy, C, Helliwell, J.R.
Deposit date:2012-01-18
Release date:2012-04-25
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural studies of the effect that dimethyl sulfoxide (DMSO) has on cisplatin and carboplatin binding to histidine in a protein.
Acta Crystallogr.,Sect.D, 68, 2012
4ATH
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BU of 4ath by Molmil
MITF apo structure
Descriptor: MICROPHTHALMIA-ASSOCIATED TRANSCRIPTION FACTOR, SULFATE ION
Authors:Pogenberg, V, Milewski, M, Wilmanns, M.
Deposit date:2012-05-08
Release date:2012-12-12
Last modified:2019-07-17
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Restricted Leucine Zipper Dimerization and Specificity of DNA Recognition of the Melanocyte Master Regulator Mitf
Genes Dev., 26, 2012
4GBC
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BU of 4gbc by Molmil
Crystal structure of aspart insulin at pH 6.5
Descriptor: CHLORIDE ION, Insulin A chain, Insulin B chain, ...
Authors:Lima, L.M.T.R, Favero-Retto, M.P, Palmieri, L.C.
Deposit date:2012-07-27
Release date:2013-06-12
Last modified:2018-08-22
Method:X-RAY DIFFRACTION (1.778 Å)
Cite:A T3R3 hexamer of the human insulin variant B28Asp.
Biophys.Chem., 173, 2013
4GBK
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BU of 4gbk by Molmil
Crystal structure of aspart insulin at pH 8.5
Descriptor: CHLORIDE ION, Insulin A chain, Insulin B chain, ...
Authors:Lima, L.M.T.R, Favero-Retto, M.P, Palmieri, L.C.
Deposit date:2012-07-27
Release date:2013-06-12
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A T3R3 hexamer of the human insulin variant B28Asp.
Biophys.Chem., 173, 2013
4G8O
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BU of 4g8o by Molmil
Crystal Structure of a novel small molecule inactivator bound to plasminogen activator inhibitor-1
Descriptor: (2S)-3-({[3-(trifluoromethyl)phenoxy]carbonyl}amino)propane-1,2-diyl bis(3,4,5-trihydroxybenzoate), 1,2-ETHANEDIOL, Plasminogen activator inhibitor 1, ...
Authors:Stuckey, J.A, Lawrence, D.A, Li, S.-H.
Deposit date:2012-07-23
Release date:2013-12-25
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Mechanistic characterization and crystal structure of a small molecule inactivator bound to plasminogen activator inhibitor-1.
Proc.Natl.Acad.Sci.USA, 110, 2013
4J62
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BU of 4j62 by Molmil
Crystal structure of Ribonuclease A soaked in 40% Cyclohexanol: One of twelve in MSCS set
Descriptor: CYCLOHEXANOL, Ribonuclease pancreatic, SULFATE ION
Authors:Kearney, B.M, Dechene, M, Swartz, P.D, Mattos, C.
Deposit date:2013-02-11
Release date:2014-01-22
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.039 Å)
Cite:DRoP: A program for analysis of water structure on protein surfaces
to be published
4J69
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BU of 4j69 by Molmil
Crystal structure of Ribonuclease A soaked in 50% S,R,S-bisfuranol: One of twelve in MSCS set
Descriptor: (3S,3aR,6aS)-hexahydrofuro[2,3-b]furan-3-ol, Ribonuclease pancreatic, SULFATE ION
Authors:Kearney, B.M, Dechene, M, Swartz, P.D, Mattos, C.
Deposit date:2013-02-11
Release date:2014-01-22
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.892 Å)
Cite:DRoP: A program for analysis of water structure on protein surfaces
to be published
4J6N
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BU of 4j6n by Molmil
Crystal structure of calcium2+-free wild-type CD23 lectin domain (crystal form E)
Descriptor: Low affinity immunoglobulin epsilon Fc receptor
Authors:Dhaliwal, B, Pang, M.O.Y, Sutton, B.J.
Deposit date:2013-02-11
Release date:2013-08-28
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Conformational plasticity at the IgE-binding site of the B-cell receptor CD23.
Mol.Immunol., 56, 2013
4B1C
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BU of 4b1c by Molmil
New Aminoimidazoles as BACE-1 Inhibitors: From Rational Design to Ab- lowering in Brain
Descriptor: (2R)-2-cyclopropyl-5-methyl-2-[3-(5-prop-1-yn-1-ylpyridin-3-yl)phenyl]-2H-imidazol-4-amine, BETA-SECRETASE 1, DIMETHYL SULFOXIDE
Authors:Rahm, F, Blid, J, Ginman, T, Karlstrom, S, Kihlstrom, J, Kolmodin, K, Lindstrom, J, von Berg, S, von Kieseritzky, F, Slivo, C, Swahn, B, Viklund, J, Olsson, L, Johansson, P, Eketjall, S, Falting, J, Jeppsson, F, Stromberg, K, Janson, J, Gravenfors, Y.
Deposit date:2012-07-10
Release date:2012-10-10
Last modified:2018-02-14
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:New aminoimidazoles as beta-secretase (BACE-1) inhibitors showing amyloid-beta (A beta ) lowering in brain.
J. Med. Chem., 55, 2012
4FSE
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BU of 4fse by Molmil
crystal structure of beta-site app-cleaving enzyme 1 (bace-wt) complex with N-(N-(4-amino-3,5- dichlorobenzyl)carbamimidoyl)-3-(4-methoxyphenyl)-5- methyl-4-isothiazolecarboxamide
Descriptor: Beta-secretase 1, IODIDE ION, N-[N-(4-amino-3,5-dichlorobenzyl)carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-thiazole-4-carboxamide
Authors:Muckelbauer, J.K.
Deposit date:2012-06-27
Release date:2012-10-10
Last modified:2019-07-17
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Acyl guanidine inhibitors of beta-secretase (BACE-1): optimization of a micromolar hit to a nanomolar lead via iterative solid- and solution-phase library synthesis
J.Med.Chem., 55, 2012
4J6Q
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BU of 4j6q by Molmil
Crystal structure of calcium2+-free wild-type CD23 lectin domain (crystal form G)
Descriptor: Low affinity immunoglobulin epsilon Fc receptor
Authors:Dhaliwal, B, Pang, M.O.Y, Sutton, B.J.
Deposit date:2013-02-11
Release date:2013-08-28
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.539 Å)
Cite:Conformational plasticity at the IgE-binding site of the B-cell receptor CD23.
Mol.Immunol., 56, 2013
4G9A
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BU of 4g9a by Molmil
Crystal structure of calcium2+-bound wild-type CD23 lectin domain
Descriptor: CALCIUM ION, GLYCEROL, Low affinity immunoglobulin epsilon Fc receptor
Authors:Yuan, D, Sutton, B.J, Dhaliwal, B.
Deposit date:2012-07-23
Release date:2013-06-26
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.001 Å)
Cite:Ca2+-dependent Structural Changes in the B-cell Receptor CD23 Increase Its Affinity for Human Immunoglobulin E.
J.Biol.Chem., 288, 2013
3CHY
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BU of 3chy by Molmil
CRYSTAL STRUCTURE OF ESCHERICHIA COLI CHEY REFINED AT 1.7-ANGSTROM RESOLUTION
Descriptor: CHEY, SULFATE ION
Authors:Volz, K, Matsumura, P.
Deposit date:1991-04-22
Release date:1993-01-15
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Crystal structure of Escherichia coli CheY refined at 1.7-A resolution.
J.Biol.Chem., 266, 1991
4J9H
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BU of 4j9h by Molmil
Crystal structure of the ABL-SH3 domain complexed with the designed high-affinity peptide ligand P7 at pH 8
Descriptor: P7, SULFATE ION, Tyrosine-protein kinase ABL1
Authors:Camara-Artigas, A.
Deposit date:2013-02-16
Release date:2014-01-29
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal structure of the ABL-SH3 domain complexed with the designed high-affinity peptide ligand P7
To be Published
4GBY
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BU of 4gby by Molmil
The structure of the MFS (major facilitator superfamily) proton:xylose symporter XylE bound to D-xylose
Descriptor: D-xylose-proton symporter, beta-D-xylopyranose, nonyl beta-D-glucopyranoside
Authors:Sun, L.F, Zeng, X, Yan, C.Y, Yan, N.
Deposit date:2012-07-28
Release date:2012-10-17
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.808 Å)
Cite:Crystal structure of a bacterial homologue of glucose transporters GLUT1-4.
Nature, 490, 2012
4GCE
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BU of 4gce by Molmil
Room temperature X-ray diffraction study of a 6-fold molar excess of a cisplatin/carboplatin mixture binding to HEWL, Dataset 3
Descriptor: Cisplatin, DIMETHYL SULFOXIDE, Lysozyme C
Authors:Helliwell, J.R, Tanley, S.W.M.
Deposit date:2012-07-30
Release date:2013-01-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The crystal structure analysis of the relative binding of cisplatin and carboplatin in a mixture with histidine in a protein studied at 100 and 300 K with repeated X-ray irradiation.
Acta Crystallogr.,Sect.D, 69, 2013
4BAS
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BU of 4bas by Molmil
Structure of the Arl6 BBS3 Small GTPase from Trypanosoma brucei with bound nucleotide analogue GppNp
Descriptor: ADP-RIBOSYLATION FACTOR, PUTATIVE (SMALL GTPASE, PUTATIVE), ...
Authors:Hemsworth, G.R, Price, H.P, Smith, D.F, Wilson, K.S.
Deposit date:2012-09-15
Release date:2012-12-12
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of the Small Gtpase Arl6/Bbs3 from Trypanosomabrucei.
Protein Sci., 22, 2013
4JAC
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BU of 4jac by Molmil
Dehaloperoxidase-Hemoglobin T56S
Descriptor: AZIDE ION, Dehaloperoxidase A, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Franzen, S, Swartz, P.D.
Deposit date:2013-02-18
Release date:2013-11-27
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.934 Å)
Cite:The role of T56 in controlling the flexibility of the distal histidine in dehaloperoxidase-hemoglobin from Amphitrite ornata.
Biochim.Biophys.Acta, 1834, 2013
4AUC
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BU of 4auc by Molmil
Bovine chymosin in complex with Pepstatin A
Descriptor: 1,2-ETHANEDIOL, CADMIUM ION, CHYMOSIN, ...
Authors:Langholm Jensen, J, Navarro Poulsen, J.C, Jacobsen, J, van den Brink, J.M, Qvist, K.B, Larsen, S.
Deposit date:2012-05-16
Release date:2013-05-29
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The Structure of Bovine Chymosin in Complex with Pepstatin A
To be Published
3EXY
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BU of 3exy by Molmil
Crystal structure of the 2[4Fe-4S] ferredoxin V13G variant from allochromatium vinosum
Descriptor: Ferredoxin, IRON/SULFUR CLUSTER
Authors:Giastas, P, Saridakis, E, Mavridis, I.M.
Deposit date:2008-10-17
Release date:2009-05-05
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Insight into the protein and solvent contributions to the reduction potentials of [4Fe-4S]2+/+ clusters: crystal structures of the Allochromatium vinosum ferredoxin variants C57A and V13G and the homologous Escherichia coli ferredoxin.
J.Biol.Inorg.Chem., 14, 2009

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