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2AFI
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BU of 2afi by Molmil
Crystal Structure of MgADP bound Av2-Av1 Complex
Descriptor: 3-HYDROXY-3-CARBOXY-ADIPIC ACID, ADENOSINE-5'-DIPHOSPHATE, CALCIUM ION, ...
Authors:Tezcan, F.A, Kaiser, J.T, Mustafi, D, Walton, M.Y, Howard, J.B, Rees, D.C.
Deposit date:2005-07-25
Release date:2005-09-06
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Nitrogenase Complexes: Multiple Docking Sites for a Nucleotide Switch Protein
Science, 309, 2005
1MV0
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BU of 1mv0 by Molmil
NMR STRUCTURE OF THE TUMOR SUPPRESSOR BIN1: ALTERNATIVE SPLICING IN MELANOMA AND INTERACTION WITH C-MYC
Descriptor: Myc box-dependent-interacting protein 1, Myc proto-oncogene protein
Authors:Pineda-Lucena, A, Arrowsmith, C.H.
Deposit date:2002-09-24
Release date:2003-09-30
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:A structure-based model of the c-Myc/Bin1 protein interaction shows alternative splicing of Bin1 and c-Myc phosphorylation are key binding determinants.
J.Mol.Biol., 351, 2005
1N1Z
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BU of 1n1z by Molmil
(+)-Bornyl Diphosphate Synthase: Complex with Mg and pyrophosphate
Descriptor: (+)-bornyl diphosphate synthase, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, MAGNESIUM ION, ...
Authors:Whittington, D.A, Wise, M.L, Urbansky, M, Coates, R.M, Croteau, R.B, Christianson, D.W.
Deposit date:2002-10-21
Release date:2002-11-27
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Bornyl diphosphate synthase: Structure and strategy for carbocation manipulation by a terpenoid cyclase
Proc.Natl.Acad.Sci.USA, 99, 2002
2A6U
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BU of 2a6u by Molmil
pH evolution of tetragonal HEWL at 4 degrees Celcius.
Descriptor: Lysozyme C
Authors:Margiolaki, I.
Deposit date:2005-07-04
Release date:2006-01-03
Last modified:2018-04-25
Method:POWDER DIFFRACTION
Cite:High-throughput phase-diagram mapping via powder diffraction: a case study of HEWL versus pH.
Acta Crystallogr.,Sect.D, 61, 2005
7QTR
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BU of 7qtr by Molmil
GB1 in mammalian cells, 50 uM
Descriptor: Immunoglobulin G-binding protein G
Authors:Gerez, J.A, Prymaczok, N.C, Kadavath, H, Gosh, D, Butikofer, M, Guntert, P, Riek, R.
Deposit date:2022-01-15
Release date:2022-12-21
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:Protein structure determination in human cells by in-cell NMR and a reporter system to optimize protein delivery or transexpression.
Commun Biol, 5, 2022
6I8J
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BU of 6i8j by Molmil
Dye type peroxidase Aa from Streptomyces lividans: 131.2 kGy structure
Descriptor: Deferrochelatase/peroxidase, PROTOPORPHYRIN IX CONTAINING FE
Authors:Ebrahim, A, Moreno-Chicano, T, Worrall, J.A.R, Strange, R.W, Axford, D, Sherrell, D.A, Appleby, M, Owen, R.L.
Deposit date:2018-11-20
Release date:2019-07-31
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Dose-resolved serial synchrotron and XFEL structures of radiation-sensitive metalloproteins.
Iucrj, 6, 2019
6I8Q
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BU of 6i8q by Molmil
Dye type peroxidase Aa from Streptomyces lividans: 117.6 kGy structure
Descriptor: Deferrochelatase/peroxidase, PROTOPORPHYRIN IX CONTAINING FE
Authors:Ebrahim, A, Moreno-Chicano, T, Worrall, J.A.R, Strange, R.W, Axford, D, Sherrell, D.A, Appleby, M, Owen, R.L.
Deposit date:2018-11-20
Release date:2019-07-31
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Dose-resolved serial synchrotron and XFEL structures of radiation-sensitive metalloproteins.
Iucrj, 6, 2019
2G9O
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BU of 2g9o by Molmil
Solution structure of the apo form of the third metal-binding domain of ATP7A protein (Menkes Disease protein)
Descriptor: Copper-transporting ATPase 1
Authors:Banci, L, Bertini, I, Cantini, F, DellaMalva, N, Rosato, A, Herrmann, T, Wuthrich, K, Structural Proteomics in Europe (SPINE)
Deposit date:2006-03-07
Release date:2006-08-01
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure and intermolecular interactions of the third metal-binding domain of ATP7A, the Menkes disease protein.
J.Biol.Chem., 281, 2006
3GUB
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BU of 3gub by Molmil
Crystal structure of DAPKL93G complexed with N6-(2-Phenylethyl)adenosine
Descriptor: 9-alpha-L-lyxofuranosyl-N-(2-phenylethyl)-9H-purin-6-amine, Death-associated protein kinase 1, SULFATE ION
Authors:McNamara, L.K, Schumacher, A.M, Schavocky, J.S, Watterson, D.M, Brunzelle, J.S.
Deposit date:2009-03-29
Release date:2010-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Crystal structures of the DAPK gatekeeper mutant complexed with N6-modified adenosine analogs.
To be Published
6QTF
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BU of 6qtf by Molmil
Solution NMR of synthetic analogues of nisin and mutacin ring A and ring B - Mutacin I Ring B, major conformer
Descriptor: DCY-LEU-GLY-ALA-THR
Authors:Dickman, R, Mitchell, S.A, Figueiredo, A, Hansen, D.F, Tabor, A.B.
Deposit date:2019-02-25
Release date:2019-09-11
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Molecular Recognition of Lipid II by Lantibiotics: Synthesis and Conformational Studies of Analogues of Nisin and Mutacin Rings A and B.
J.Org.Chem., 84, 2019
6QYU
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BU of 6qyu by Molmil
Solution NMR of synthetic analogues of nisin and mutacin ring A and ring B - Mutacin I Ring A
Descriptor: PHE-DHA-DAL-LEU-DHA-LEU-CYS-ALA
Authors:Dickman, R, Mitchell, S.A, Figueiredo, A, Hansen, D.F, Tabor, A.B.
Deposit date:2019-03-09
Release date:2019-09-11
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Molecular Recognition of Lipid II by Lantibiotics: Synthesis and Conformational Studies of Analogues of Nisin and Mutacin Rings A and B.
J.Org.Chem., 84, 2019
6R1V
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BU of 6r1v by Molmil
Solution structure of sortase A from S. aureus in complex with 2-(aminomethyl)-3-hydroxy-4H-pyran-4-one based prodrug
Descriptor: 6-(hydroxymethyl)-3-oxidanyl-2-(thiophen-3-ylmethyl)pyran-4-one, Sortase A
Authors:Jaudzems, K, Leonchiks, A.
Deposit date:2019-03-15
Release date:2020-01-22
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Targeting Bacterial Sortase A with Covalent Inhibitors: 27 New Starting Points for Structure-Based Hit-to-Lead Optimization.
Acs Infect Dis., 6, 2020
6QYR
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BU of 6qyr by Molmil
Solution NMR of synthetic analogues of nisin and mutacin ring A and ring B - Mutacin I Ring B, minor conformer
Descriptor: DAL-LEU-GLY-CYS-THR
Authors:Dickman, R, Mitchell, S.A, Figueiredo, A, Hansen, D.F, Tabor, A.B.
Deposit date:2019-03-09
Release date:2019-09-11
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Molecular Recognition of Lipid II by Lantibiotics: Synthesis and Conformational Studies of Analogues of Nisin and Mutacin Rings A and B.
J.Org.Chem., 84, 2019
6QM1
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BU of 6qm1 by Molmil
Solution NMR of synthetic analogues of nisin and mutacin ring A and ring B - Nisin Ring B (Lan8,11) analogue
Descriptor: DAL-PRO-GLY-CYS-LYS
Authors:Dickman, R, Mitchell, S.A, Figueiredo, A, Hansen, D.F, Tabor, A.B.
Deposit date:2019-02-01
Release date:2019-09-11
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Molecular Recognition of Lipid II by Lantibiotics: Synthesis and Conformational Studies of Analogues of Nisin and Mutacin Rings A and B.
J.Org.Chem., 84, 2019
6R95
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BU of 6r95 by Molmil
The solution NMR structure of cis-dicarba-brevinin-1BYa in 33% trifluoroethanol
Descriptor: Brevinin-1BYa
Authors:Timmons, P.B, O'Flynn, D.P, Conlon, J.M, Hewage, C.M.
Deposit date:2019-04-02
Release date:2019-09-25
Last modified:2023-11-15
Method:SOLUTION NMR
Cite:Insights into conformation and membrane interactions of the acyclic and dicarba-bridged brevinin-1BYa antimicrobial peptides.
Eur.Biophys.J., 48, 2019
6R5G
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BU of 6r5g by Molmil
C-SH2 domain of SHP-2 in complex with phospho-ITSM of PD-1
Descriptor: ITSM, Tyrosine-protein phosphatase non-receptor type 11
Authors:Marasco, M.
Deposit date:2019-03-25
Release date:2020-02-05
Last modified:2024-10-09
Method:SOLUTION NMR
Cite:Molecular mechanism of SHP2 activation by PD-1 stimulation.
Sci Adv, 6, 2020
3GU8
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BU of 3gu8 by Molmil
Crystal structure of DAPKL93G with N6-cyclopentyladenosine
Descriptor: Death-associated protein kinase 1, N6-cyclopentyladenosine
Authors:McNamara, L.K, Schumacher, A.M, Schavocky, J.S, Watterson, D.M, Brunzelle, J.S.
Deposit date:2009-03-28
Release date:2010-03-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structures of the DAPK gatekeeper mutant with N6-modified adenosine analogs.
To be Published
6I1O
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BU of 6i1o by Molmil
Fab fragment of an antibody selective for wild-type alpha-1-antitrypsin
Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, FAB 2H2 heavy chain, FAB 2H2 light chain, ...
Authors:Laffranchi, M, Elliston, E.L.K, Miranda, E, Perez, J, Fra, A, Lomas, D.A, Irving, J.A.
Deposit date:2018-10-29
Release date:2019-11-20
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Intrahepatic heteropolymerization of M and Z alpha-1-antitrypsin.
JCI Insight, 5, 2020
1DH3
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BU of 1dh3 by Molmil
CRYSTAL STRUCTURE OF A CREB BZIP-CRE COMPLEX REVEALS THE BASIS FOR CREB FAIMLY SELECTIVE DIMERIZATION AND DNA BINDING
Descriptor: DNA (5'-D(*CP*CP*TP*TP*GP*GP*CP*TP*GP*AP*CP*GP*TP*CP*AP*GP*CP*CP*AP*AP*G)-3'), MAGNESIUM ION, TRANSCRIPTION FACTOR CREB
Authors:Schumacher, M.A, Goodman, R.H, Brennan, R.G.
Deposit date:1999-11-27
Release date:2000-11-27
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (3 Å)
Cite:The structure of a CREB bZIP.somatostatin CRE complex reveals the basis for selective dimerization and divalent cation-enhanced DNA binding
J.Biol.Chem., 275, 2000
6I2O
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BU of 6i2o by Molmil
Solution NMR structure of PilE1 from Streptococcus sanguinis
Descriptor: Type IV pilin PilE1
Authors:Berry, J.L, Xu, Y.
Deposit date:2018-11-01
Release date:2019-03-13
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Global biochemical and structural analysis of the type IV pilus from the Gram-positive bacteriumStreptococcus sanguinis.
J.Biol.Chem., 294, 2019
6LCI
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BU of 6lci by Molmil
Solution structure of mdaA-1 domain
Descriptor: mdaA-1
Authors:Nguyen, T.A, Le, S, Lee, M, Fan, J.S, Yang, D, Yan, J, Jedd, G.
Deposit date:2019-11-19
Release date:2020-11-25
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Fungal Wound Healing through Instantaneous Protoplasmic Gelation.
Curr.Biol., 31, 2021
6L8M
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BU of 6l8m by Molmil
WNT DNA promoter mutant G-quadruplex
Descriptor: DNA (5'-D(*GP*GP*GP*TP*CP*AP*CP*CP*GP*GP*GP*CP*AP*GP*TP*GP*GP*GP*CP*GP*GP*G)-3')
Authors:Wang, Z.F, Li, M.H, Chu, I.T, Winnerdy, F.R, Phan, A.T, Chang, T.C.
Deposit date:2019-11-06
Release date:2019-12-11
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Cytosine epigenetic modification modulates the formation of an unprecedented G4 structure in the WNT1 promoter.
Nucleic Acids Res., 48, 2020
6L7K
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BU of 6l7k by Molmil
solution structure of hIFABP V60C/Y70C variant.
Descriptor: Fatty acid-binding protein, intestinal
Authors:Fan, J, Yang, D.
Deposit date:2019-11-01
Release date:2020-11-04
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Ligand Entry into Fatty Acid Binding Protein via Local Unfolding Instead of Gap Widening.
Biophys.J., 118, 2020
2HFQ
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BU of 2hfq by Molmil
NMR structure of protein NE1680 from Nitrosomonas europaea: Northeast Structural Genomics Consortium target NeT5
Descriptor: Hypothetical protein
Authors:Cort, J.R, Yee, A.A, Yim, V, Lukin, J, Kennedy, M.A, Northeast Structural Genomics Consortium (NESG)
Deposit date:2006-06-25
Release date:2006-09-19
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:NMR structure of protein NE1680 from Nitrosomonas europaea: Northeast Structural Genomics Consortium target NeT5
TO BE PUBLISHED
2HQW
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BU of 2hqw by Molmil
Crystal Structure of Ca2+/Calmodulin bound to NMDA Receptor NR1C1 peptide
Descriptor: CALCIUM ION, Calmodulin, Glutamate NMDA receptor subunit zeta 1
Authors:Akyol, Z, Gakhar, L, Sorensen, B.R, Hell, J.H, Shea, M.A.
Deposit date:2006-07-19
Release date:2007-11-13
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The NMDA Receptor NR1 C1 Region Bound to Calmodulin: Structural Insights into Functional Differences between Homologous Domains.
Structure, 15, 2007

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