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2WV8
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BU of 2wv8 by Molmil
Complex of human dihydroorotate dehydrogenase with the inhibitor 221290
Descriptor: 2-ACETAMIDO-5-(4-PHENYLPHENYL)BENZOIC ACID, ACETATE ION, DECYLAMINE-N,N-DIMETHYL-N-OXIDE, ...
Authors:Walse, B, Svensson, B, Fritzson, I, Dahlberg, L, Wellmar, U, Al-Karadaghi, S.
Deposit date:2009-10-15
Release date:2010-08-25
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Inhibition of Human Dhodh by 4-Hydroxycoumarins, Fenamic Acids, and N-(Alkylcarbonyl)Anthranilic Acids Identified by Structure-Guided Fragment Selection.
Chemmedchem, 5, 2010
7MN2
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BU of 7mn2 by Molmil
Rules for designing protein fold switches and their implications for the folding code
Descriptor: Sb2
Authors:He, Y, Chen, Y, Ruan, B, Choi, J, Chen, Y, Motabar, D, Solomon, T, Simmerman, R, Kauffman, T, Gallagher, T, Bryan, P, Orban, J.
Deposit date:2021-04-30
Release date:2022-05-18
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Design and characterization of a protein fold switching network.
Nat Commun, 14, 2023
7MLL
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BU of 7mll by Molmil
Solution structure of Exenatide (exendin-4) in 30-vol% trifluoroethanol using CS-Rosetta
Descriptor: Exendin-4
Authors:Mishra, S.H, Bhavaraju, S.
Deposit date:2021-04-28
Release date:2021-05-19
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Facilitated structure verification of the biopharmaceutical peptide exenatide by 2D heteronuclear NMR maps.
J Pharm Biomed Anal, 203, 2021
7MP7
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BU of 7mp7 by Molmil
Rules for designing protein fold switches and their implications for the folding code
Descriptor: Sb3
Authors:He, Y, Chen, Y, Ruan, B, Choi, J, Chen, Y, Motabar, D, Solomon, T, Simmerman, R, Kauffman, T, Gallagher, T, Bryan, P, Orban, J.
Deposit date:2021-05-04
Release date:2022-05-18
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Design and characterization of a protein fold switching network.
Nat Commun, 14, 2023
7MN1
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BU of 7mn1 by Molmil
Rules for designing protein fold switches and their implications for the folding code
Descriptor: Sa1
Authors:He, Y, Chen, Y, Ruan, B, Choi, J, Chen, Y, Motabar, D, Solomon, T, Simmerman, R, Kauffman, T, Gallagher, T, Bryan, P, Orban, J.
Deposit date:2021-04-30
Release date:2022-05-18
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Design and characterization of a protein fold switching network.
Nat Commun, 14, 2023
7MQ4
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BU of 7mq4 by Molmil
Rules for designing protein fold switches and their implications for the folding code
Descriptor: Sb1
Authors:He, Y, Chen, Y, Ruan, B, Choi, J, Chen, Y, Motabar, D, Solomon, T, Simmerman, R, Kauffman, T, Gallagher, T, Bryan, P, Orban, J.
Deposit date:2021-05-05
Release date:2022-05-18
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Design and characterization of a protein fold switching network.
Nat Commun, 14, 2023
8GA9
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BU of 8ga9 by Molmil
C4HR1_4r: Extendable repeat protein tetramer
Descriptor: C4HR1_4r
Authors:Bethel, N.P, Borst, A.J.
Deposit date:2023-02-22
Release date:2023-08-30
Last modified:2023-12-20
Method:ELECTRON MICROSCOPY (3.71 Å)
Cite:Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8G8I
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BU of 8g8i by Molmil
C3HR3_9r_shift4: Extendable repeat protein fiber
Descriptor: C3HR3_9r_shift4
Authors:Bethel, N.P, Borst, A.J.
Deposit date:2023-02-17
Release date:2023-08-30
Last modified:2023-12-13
Method:ELECTRON MICROSCOPY (3.92 Å)
Cite:Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8GAQ
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BU of 8gaq by Molmil
C5HR2_4r: Extendable repeat protein pentamer
Descriptor: C5HR2_4r
Authors:Bethel, N.P, Borst, A.J.
Deposit date:2023-02-23
Release date:2023-08-30
Last modified:2023-12-20
Method:ELECTRON MICROSCOPY (3.73 Å)
Cite:Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8GAA
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BU of 8gaa by Molmil
C6HR1_4r: Extendable repeat protein hexamer
Descriptor: C6HR1_4r
Authors:Bethel, N.P, Borst, A.J, Baker, D.
Deposit date:2023-02-22
Release date:2023-08-30
Last modified:2023-12-20
Method:ELECTRON MICROSCOPY (4.24 Å)
Cite:Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8GOI
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BU of 8goi by Molmil
23-residues Heterotetramic Antiparallel Coiled-Coil Derived From LacI
Descriptor: GLYCEROL, Lac23ys_aEE, an acidic mutant of LacI C-terminal tetramerization helix, ...
Authors:Kumasaka, T.
Deposit date:2022-08-25
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Design of interchain Glu-Arg salt-bridges stabilizing heterotetrameric coiled-coil derived from Lac repressor.
To Be Published
8GOJ
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BU of 8goj by Molmil
23-residues Heterotetramic Antiparallel Coiled-Coil Derived From LacI
Descriptor: Lac23ys_EE, an acidic mutant of LacI C-terminal tetramerization helix, Lac23ys_KK, ...
Authors:Kumasaka, T.
Deposit date:2022-08-25
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Design of interchain Glu-Arg salt-bridges stabilizing heterotetrameric coiled-coil derived from Lac repressor.
To Be Published
7NBI
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BU of 7nbi by Molmil
Crystal structure of a monomeric FLT3 Ligand variant
Descriptor: Fms-related tyrosine kinase 3 ligand, SULFATE ION
Authors:Pannecoucke, E, Raes, L, Savvides, S.N.
Deposit date:2021-01-26
Release date:2021-04-28
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Engineering and crystal structure of a monomeric FLT3 ligand variant.
Acta Crystallogr.,Sect.F, 77, 2021
8GJC
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BU of 8gjc by Molmil
X-ray crystallographic structure of a beta-hairpin peptide derived from Abeta 17-35. (ORN)LVFFAED(ORN)GAI(N-Me-Ile)GLM
Descriptor: DI(HYDROXYETHYL)ETHER, METHIONINE, beta-hairpin peptide derived from Abeta 17-35, ...
Authors:Kreutzer, A.G, Ruttenberg, S.M, Nowick, J.S.
Deposit date:2023-03-15
Release date:2024-01-17
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.431 Å)
Cite:beta-Hairpin Alignment Alters Oligomer Formation in A beta-Derived Peptides.
Biochemistry, 63, 2024
8GJD
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BU of 8gjd by Molmil
X-ray crystallographic structure of a beta-hairpin peptide derived from Abeta 17-36. (ORN)LVFFAED(ORN)AII(N-Me-Gly)LMV
Descriptor: Beta-hairpin peptide derived from Abeta 17-36, IODIDE ION
Authors:Kreutzer, A.G, Ruttenberg, S.M, Nowick, J.S, Truex, N.L.
Deposit date:2023-03-15
Release date:2024-01-17
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:beta-Hairpin Alignment Alters Oligomer Formation in A beta-Derived Peptides.
Biochemistry, 63, 2024
7NLV
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BU of 7nlv by Molmil
WILDTYPE CORE-STREPTAVIDIN WITH a conjugated BIOTINYLATED PYRROLIDINE II
Descriptor: 5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-N-((S)-pyrrolidin-3-yl)pentanamide, Streptavidin
Authors:Nodling, A.R, Santi, N, Tsai, Y.H, Rizkallah, P, Luk, L.Y.P, Jin, Y.
Deposit date:2021-02-22
Release date:2022-03-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:The role of streptavidin and its variants in catalysis by biotinylated secondary amines.
Org.Biomol.Chem., 19, 2021
2N6B
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BU of 2n6b by Molmil
NMR structure of the de-novo toxin Hui1
Descriptor: Hui1
Authors:Mendelman, N, Zhao, R, Goldstein, S.A.N, Chill, J.H.
Deposit date:2015-08-17
Release date:2015-12-16
Last modified:2015-12-30
Method:SOLUTION NMR
Cite:Designer and natural peptide toxin blockers of the KcsA potassium channel identified by phage display.
Proc.Natl.Acad.Sci.USA, 112, 2015
8XJ3
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BU of 8xj3 by Molmil
Crystal structure of methyltransferase CbiL from Akkermansia muciniphila
Descriptor: CbiL
Authors:Guo, S, Jiang, M, Wang, M.
Deposit date:2023-12-20
Release date:2024-06-05
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of methyltransferase CbiL from Akkermansia muciniphila.
Biochem.Biophys.Res.Commun., 722, 2024
8G0Y
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BU of 8g0y by Molmil
Backbone modifications in the inter-helix loop of designed miniprotein oPPalpha: Iva10Asn11 turn
Descriptor: Designed miniprotein oPPalpha: Iva10Asn11 turn
Authors:Harmon, T.W, Horne, W.S.
Deposit date:2023-02-01
Release date:2023-04-05
Last modified:2023-11-15
Method:SOLUTION NMR
Cite:Protein Backbone Alteration in Non-Hairpin beta-Turns: Impacts on Tertiary Folded Structure and Folded Stability.
Chembiochem, 24, 2023
8G0X
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BU of 8g0x by Molmil
Backbone modifications in the inter-helix loop of designed miniprotein oPPalpha: Pro10DPro11 turn
Descriptor: Designed miniprotein oPPalpha: Pro10DPro11 turn
Authors:Harmon, T.W, Horne, W.S.
Deposit date:2023-02-01
Release date:2023-04-05
Last modified:2023-06-28
Method:SOLUTION NMR
Cite:Protein Backbone Alteration in Non-Hairpin beta-Turns: Impacts on Tertiary Folded Structure and Folded Stability.
Chembiochem, 24, 2023
7OBI
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BU of 7obi by Molmil
Consensus tetratricopeptide repeat protein type RV4
Descriptor: CTPR-rv4, PHOSPHATE ION
Authors:Eapen, R.S, Perez-Riba, A, Fischer, G, Itzhaki, L.S, Hyvonen, M.
Deposit date:2021-04-22
Release date:2022-02-23
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (3 Å)
Cite:Unraveling the Mechanics of a Repeat-Protein Nanospring: From Folding of Individual Repeats to Fluctuations of the Superhelix.
Acs Nano, 16, 2022
8I8Y
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BU of 8i8y by Molmil
A mutant of the C-terminal complex of proteins 4.1G and NuMA
Descriptor: Engineered protein
Authors:Hu, X.
Deposit date:2023-02-06
Release date:2023-04-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Combined prediction and design reveals the target recognition mechanism of an intrinsically disordered protein interaction domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8JKU
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BU of 8jku by Molmil
Ancestal imine reductase
Descriptor: Ancestral imine reductase N559, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Zhu, X.X, Zheng, G.W.
Deposit date:2023-06-01
Release date:2023-08-09
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Structure of ancestral imine reductase at 2.56 Angstroms resolution.
To Be Published
1Y47
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BU of 1y47 by Molmil
Structural studies of designed alpha-helical hairpins
Descriptor: CADMIUM ION, dueferri (DF2)
Authors:Lahr, S.J, Engel, D.E, Stayrook, S.E, Maglio, O, North, B, Geremia, S, Lombardi, A, DeGrado, W.F.
Deposit date:2004-11-30
Release date:2005-03-22
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Analysis and design of turns in alpha-helical hairpins
J.Mol.Biol., 346, 2005
1XOF
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BU of 1xof by Molmil
Heterooligomeric Beta Beta Alpha Miniprotein
Descriptor: BBAhetT1
Authors:Ali, M.H, Taylor, C.M, Grigoryan, G, Allen, K.N, Imperiali, B, Keating, A.E.
Deposit date:2004-10-06
Release date:2005-02-01
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Design of a Heterospecific, Tetrameric, 21-Residue Miniprotein with Mixed alpha/beta Structure.
Structure, 13, 2005

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