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4WE3
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BU of 4we3 by Molmil
STRUCTURE OF THE BINARY COMPLEX OF A ZINGIBER OFFICINALE DOUBLE BOND REDUCTASE IN COMPLEX WITH NADP MONOCLINIC CRYSTAL FORM
Descriptor: Double Bond Reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Collery, J, Langlois d'Estaintot, B, Buratto, J, Granier, T, Gallois, B, Willis, M.A, Sang, Y, Flores-Sanchez, I.J, Gang, D.R.
Deposit date:2014-09-09
Release date:2015-09-30
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:STRUCTURE OF ZINGIBER OFFICINALE DOUBLE BOND REDUCTASE
to be published
5CVH
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BU of 5cvh by Molmil
Crystal Structure of CK2alpha
Descriptor: ACETATE ION, ADENOSINE-5'-DIPHOSPHATE, Casein kinase II subunit alpha, ...
Authors:Brear, P, De Fusco, C, Georgiou, K.H, Spring, D, Hyvonen, M.
Deposit date:2015-07-26
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.848 Å)
Cite:Specific inhibition of CK2 alpha from an anchor outside the active site.
Chem Sci, 7, 2016
7S1T
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BU of 7s1t by Molmil
Structure of the human POT1-TPP1 complex
Descriptor: Adrenocortical dysplasia protein homolog, Protection of telomeres protein 1, ZINC ION
Authors:Aramburu, T, Skordalakes, E.
Deposit date:2021-09-02
Release date:2022-01-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:POT1-TPP1 binding stabilizes POT1, promoting efficient telomere maintenance.
Comput Struct Biotechnol J, 20, 2022
5CW3
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BU of 5cw3 by Molmil
Structure of CfBRCC36-CfKIAA0157 complex (Zn Edge)
Descriptor: BRCA1/BRCA2-containing complex subunit 3, Protein FAM175B, ZINC ION
Authors:Zeqiraj, E.
Deposit date:2015-07-27
Release date:2015-09-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Higher-Order Assembly of BRCC36-KIAA0157 Is Required for DUB Activity and Biological Function.
Mol.Cell, 59, 2015
5CWN
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BU of 5cwn by Molmil
Crystal structure of de novo designed helical repeat protein DHR71
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Designed helical repeat protein, TETRAETHYLENE GLYCOL
Authors:Bhabha, G, Ekiert, D.C.
Deposit date:2015-07-28
Release date:2015-12-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Exploring the repeat protein universe through computational protein design.
Nature, 528, 2015
8RH9
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BU of 8rh9 by Molmil
CryoEM structure of human rho1 GABAA receptor in complex with pregnenolone sulfate
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, DECANE, ...
Authors:Chen, F, John, C, Rebecca, J.H, Erik, L.
Deposit date:2023-12-15
Release date:2024-08-28
Last modified:2025-07-09
Method:ELECTRON MICROSCOPY (3.21 Å)
Cite:Divergent mechanisms of steroid inhibition in the human rho1 GABAA receptor
Nat Commun, 2024
7S1O
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BU of 7s1o by Molmil
Structure of human POT1C
Descriptor: Protection of telomeres protein 1, ZINC ION
Authors:Aramburu, T, Skordalakes, E.
Deposit date:2021-09-02
Release date:2022-01-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:POT1-TPP1 binding stabilizes POT1, promoting efficient telomere maintenance.
Comput Struct Biotechnol J, 20, 2022
8RH4
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BU of 8rh4 by Molmil
CryoEM structure of human rho1 GABAA receptor in complex with estradiol
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, DECANE, ...
Authors:Chen, F, John, C, Rebecca, J.H, Erik, L.
Deposit date:2023-12-14
Release date:2024-08-28
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (2.52 Å)
Cite:Divergent mechanisms of steroid inhibition in the human rho1 GABAA receptor
Nat Commun, 2024
4W9L
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BU of 4w9l by Molmil
pVHL:EloB:EloC in complex with (2S,4R)-1-((S)-2-((S)-2-acetamido-3,3-dimethylbutanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide (ligand 15)
Descriptor: N-acetyl-3-methyl-L-valyl-3-methyl-L-valyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]-L-prolinamide, Transcription elongation factor B polypeptide 1, Transcription elongation factor B polypeptide 2, ...
Authors:Gadd, M.S, Galdeano, C, van Molle, I, Ciulli, A.
Deposit date:2014-08-27
Release date:2014-09-10
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure-Guided Design and Optimization of Small Molecules Targeting the Protein-Protein Interaction between the von Hippel-Lindau (VHL) E3 Ubiquitin Ligase and the Hypoxia Inducible Factor (HIF) Alpha Subunit with in Vitro Nanomolar Affinities.
J.Med.Chem., 57, 2014
4WA7
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BU of 4wa7 by Molmil
Crystal Structure of a GDP-bound Q61L Oncogenic Mutant of Human GT- Pase KRas
Descriptor: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Hunter, J.C, Manandhar, A, Gurbani, D, Chen, Z, Westover, K.D.
Deposit date:2014-08-28
Release date:2015-06-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.986 Å)
Cite:Biochemical and Structural Analysis of Common Cancer-Associated KRAS Mutations.
Mol Cancer Res., 13, 2015
5CV6
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BU of 5cv6 by Molmil
Crystal structure of Staphylococcal nuclease variant Delta+PHS V66H/I92E at cryogenic temperature
Descriptor: CALCIUM ION, THYMIDINE-3',5'-DIPHOSPHATE, Thermonuclease
Authors:Theodoru, A, Robinson, A.C, Schlessman, J.L, Garcia-Moreno E, B.
Deposit date:2015-07-25
Release date:2015-08-12
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structure of Staphylococcal nuclease variant Delta+PHS V66H/I92E at cryogenic temperature
To be Published
2IPN
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BU of 2ipn by Molmil
Crystal structure of a disulfide mutant glucose binding protein
Descriptor: CALCIUM ION, D-galactose-binding periplasmic protein, beta-D-glucopyranose
Authors:Cuneo, M.J, Hellinga, H.W.
Deposit date:2006-10-12
Release date:2007-03-20
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:The free energy cost of domain reorganization in E. coli glucose binding protein
To be Published
8RH7
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BU of 8rh7 by Molmil
CryoEM structure of human rho1 GABAA receptor in complex with GABA and estradiol in primed state
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ESTRADIOL, ...
Authors:Chen, F, John, C, Rebecca, J.H, Erik, L.
Deposit date:2023-12-15
Release date:2024-08-28
Last modified:2025-07-09
Method:ELECTRON MICROSCOPY (2.78 Å)
Cite:Divergent mechanisms of steroid inhibition in the human rho1 GABAA receptor
Nat Commun, 2024
5D0J
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BU of 5d0j by Molmil
Grb7 SH2 with inhibitor peptide
Descriptor: G7-TEdFP peptide, Growth factor receptor-bound protein 7, PHOSPHATE ION
Authors:Gunzburg, M.J, Watson, G.M, Wilce, J.A, Wilce, M.C.J.
Deposit date:2015-08-03
Release date:2016-06-15
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Unexpected involvement of staple leads to redesign of selective bicyclic peptide inhibitor of Grb7.
Sci Rep, 6, 2016
5CVF
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BU of 5cvf by Molmil
Crystal Structure of CK2alpha with Compound 5 bound
Descriptor: 1-[3-chloro-4-(trifluoromethoxy)phenyl]methanamine, ACETATE ION, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Brear, P, De Fusco, C, Georgiou, K.H, Spring, D, Hyvonen, M.
Deposit date:2015-07-26
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Specific inhibition of CK2 alpha from an anchor outside the active site.
Chem Sci, 7, 2016
8RU4
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BU of 8ru4 by Molmil
Crystal structure of Human Catenin Beta-1 in complex with stitched peptide inhibitor
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Axin-1, CHLORIDE ION, ...
Authors:Yeste Vazquez, A, Klintrot, C.I.R, Grossmann, T.N, Hennig, S.
Deposit date:2024-01-30
Release date:2024-09-04
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:Structure-Based Design of Bicyclic Helical Peptides That Target the Oncogene beta-Catenin.
Angew.Chem.Int.Ed.Engl., 63, 2024
4WB5
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BU of 4wb5 by Molmil
Crystal structure of human cAMP-dependent protein kinase A (catalytic alpha subunit)
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, PKI (5-24), ...
Authors:Cheung, J, Ginter, C, Cassidy, M, Franklin, M.C, Rudolph, M.J, Hendrickson, W.A.
Deposit date:2014-09-02
Release date:2015-01-21
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.641 Å)
Cite:Structural insights into mis-regulation of protein kinase A in human tumors.
Proc.Natl.Acad.Sci.USA, 112, 2015
4WBC
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BU of 4wbc by Molmil
2.13 A STRUCTURE OF A KUNITZ-TYPE WINGED BEAN CHYMOTRYPSIN INHIBITOR PROTEIN
Descriptor: PROTEIN (CHYMOTRYPSIN INHIBITOR), SULFATE ION
Authors:Ravichandran, S, Sen, U, Chakrabarti, C, Dattagupta, J.K.
Deposit date:1999-03-04
Release date:1999-03-12
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.138 Å)
Cite:Cryocrystallography of a Kunitz-type serine protease inhibitor: the 90 K structure of winged bean chymotrypsin inhibitor (WCI) at 2.13 A resolution.
Acta Crystallogr.,Sect.D, 55, 1999
5CWC
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BU of 5cwc by Molmil
Crystal structure of de novo designed helical repeat protein DHR5
Descriptor: 1,2-ETHANEDIOL, Designed helical repeat protein
Authors:Bhabha, G, Ekiert, D.C.
Deposit date:2015-07-27
Release date:2015-12-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Exploring the repeat protein universe through computational protein design.
Nature, 528, 2015
4WBJ
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BU of 4wbj by Molmil
Crystal structure of Bradyrhizobium japonicum ScoI in the oxidized state
Descriptor: Blr1131 protein, SUCCINIC ACID
Authors:Quade, N, Abicht, H.K, Hennecke, H, Glockshuber, R.
Deposit date:2014-09-03
Release date:2015-09-23
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Crystal structure of Bradyrhizobium japonicum ScoI in the oxidized state
To Be Published
4WC1
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BU of 4wc1 by Molmil
Structure of tRNA-processing enzyme with CTP
Descriptor: CYTIDINE-5'-TRIPHOSPHATE, Poly A polymerase
Authors:Yamashita, S, Tomita, K.
Deposit date:2014-09-04
Release date:2015-04-15
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Measurement of Acceptor-T Psi C Helix Length of tRNA for Terminal A76-Addition by A-Adding Enzyme.
Structure, 23, 2015
7S1U
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BU of 7s1u by Molmil
Structure of human POT1C
Descriptor: Protection of telomeres protein 1, ZINC ION
Authors:Aramburu, T, Skordalakes, E.
Deposit date:2021-09-02
Release date:2022-01-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:POT1-TPP1 binding stabilizes POT1, promoting efficient telomere maintenance.
Comput Struct Biotechnol J, 20, 2022
4WCG
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BU of 4wcg by Molmil
The binding mode of Cyprinid Herpesvirus3 ORF112-Zalpha to Z-DNA
Descriptor: DNA (5'-D(P*CP*GP*CP*GP*CP*G)-3'), ORF112, SULFATE ION
Authors:Kus, K, Athanasiadis, A.
Deposit date:2014-09-04
Release date:2015-11-18
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The Structure of the Cyprinid herpesvirus 3 ORF112-Z alpha Z-DNA Complex Reveals a Mechanism of Nucleic Acids Recognition Conserved with E3L, a Poxvirus Inhibitor of Interferon Response.
J.Biol.Chem., 290, 2015
5CWM
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BU of 5cwm by Molmil
Crystal structure of de novo designed helical repeat protein DHR64
Descriptor: Designed helical repeat protein
Authors:Bhabha, G, Ekiert, D.C.
Deposit date:2015-07-28
Release date:2015-12-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Exploring the repeat protein universe through computational protein design.
Nature, 528, 2015
4WCN
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BU of 4wcn by Molmil
Crystal Structure of Tripeptide bound Cell Shape Determinant Csd4 protein from Helicobacter pylori
Descriptor: Conserved hypothetical secreted protein, IODIDE ION, N-acetyl-L-alanyl-N-[(1S,5R)-5-amino-1,5-dicarboxypentyl]-D-glutamine, ...
Authors:Chan, A.C, Murphy, M.E.
Deposit date:2014-09-05
Release date:2014-12-24
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Helical Shape of Helicobacter pylori Requires an Atypical Glutamine as a Zinc Ligand in the Carboxypeptidase Csd4.
J.Biol.Chem., 290, 2015

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