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7LOM
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BU of 7lom by Molmil
Ornithine Aminotransferase (OAT) soaked with its inactivator - (1S,3S)-3-amino-4-(difluoromethylene)cyclohexene-1-carboxylic acid
Descriptor: (3~{S},4~{S})-4-methyl-3-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]cyclohexene-1-carboxylic acid, (4~{R})-4-(fluoranylmethyl)-3-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]cyclohexene-1-carboxylic acid, Ornithine aminotransferase, ...
Authors:Butrin, A, Zhu, W, Liu, D, Silverman, R.
Deposit date:2021-02-10
Release date:2021-08-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Remarkable and Unexpected Mechanism for ( S )-3-Amino-4-(difluoromethylenyl)cyclohex-1-ene-1-carboxylic Acid as a Selective Inactivator of Human Ornithine Aminotransferase.
J.Am.Chem.Soc., 143, 2021
1M2X
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BU of 1m2x by Molmil
Crystal Structure of the metallo-beta-lactamase BlaB of Chryseobacterium meningosepticum in complex with the inhibitor D-captopril
Descriptor: 1-(3-MERCAPTO-2-METHYL-PROPIONYL)-PYRROLIDINE-2-CARBOXYLIC ACID, GLYCEROL, SODIUM ION, ...
Authors:Garcia-Saez, I, Dideberg, O.
Deposit date:2002-06-26
Release date:2003-07-29
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The 1.5 A structure of Chryseobacterium meningosepticum Zn-beta-lactamase in complex with the inhibitor, D-captopril
J.Biol.Chem., 278, 2003
2XO7
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BU of 2xo7 by Molmil
Crystal structure of a dA:O-allylhydroxylamine-dC basepair in complex with fragment DNA polymerase I from Bacillus stearothermophilus
Descriptor: 5'-D(*AP*GP*GP*AP*AP*TP*GP*GP*TP*CP*A)-3', 5'-D(*GP*AP*CP*CP*AP*TP*47C*CP*CP*T)-3', DNA POLYMERASE I, ...
Authors:Muenzel, M, Lercher, L, Mueller, M, Carell, T.
Deposit date:2010-08-10
Release date:2010-09-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Chemical Discrimination between Dc and 5Medc Via Their Hydroxylamine Adducts
Nucleic Acids Res., 38, 2010
5VQ2
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BU of 5vq2 by Molmil
Crystal structure of human WT-KRAS in complex with GTP
Descriptor: GTPase KRas, GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION
Authors:Xu, S, Long, B, Boris, G, Ni, S, Kennedy, M.A.
Deposit date:2017-05-07
Release date:2017-12-06
Last modified:2017-12-20
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Structural insight into the rearrangement of the switch I region in GTP-bound G12A K-Ras.
Acta Crystallogr D Struct Biol, 73, 2017
6Q7I
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BU of 6q7i by Molmil
GH3 exo-beta-xylosidase (XlnD)
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Davies, G.J, Rowland, R.J, Wu, L, Moroz, O, Blagova, E.
Deposit date:2018-12-13
Release date:2019-06-05
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Dynamic and Functional Profiling of Xylan-Degrading Enzymes inAspergillusSecretomes Using Activity-Based Probes.
Acs Cent.Sci., 5, 2019
7LDV
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BU of 7ldv by Molmil
Zoogloea ramigera biosynthetic thiolase Q183Y/Y218E/delH221/S227K mutant
Descriptor: AMMONIUM ION, Acetyl-CoA acetyltransferase, CHLORIDE ION, ...
Authors:Marshall, A.C, Bruning, J.B.
Deposit date:2021-01-14
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Engineering potassium activation into biosynthetic thiolase.
Biochem.J., 478, 2021
1M5N
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BU of 1m5n by Molmil
Crystal structure of HEAT repeats (1-11) of importin b bound to the non-classical NLS(67-94) of PTHrP
Descriptor: Importin beta-1 subunit, Parathyroid hormone-related protein
Authors:Cingolani, G, Bednenko, J, Gillespie, M.T, Gerace, L.
Deposit date:2002-07-09
Release date:2003-01-21
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Molecular basis for the recognition of a nonclassical nuclear localization signal by importin beta
Mol.Cell, 10, 2002
7LPQ
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BU of 7lpq by Molmil
Crystal structure of Cryptococcus neoformans sterylglucosidase 1 with hit 9
Descriptor: Cytoplasmic protein, GLYCEROL, MAGNESIUM ION, ...
Authors:Pereira de Sa, N, Del Poeta, M, Airola, M.V.
Deposit date:2021-02-12
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.32 Å)
Cite:Structure and inhibition of Cryptococcus neoformans sterylglucosidase to develop antifungal agents.
Nat Commun, 12, 2021
1M6A
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BU of 1m6a by Molmil
NMR structure of the i-Motif Tetramer Formed by XC2
Descriptor: 5'-D(*CP*C)-3'
Authors:Malliavin, T.E, Snoussi, K, Leroy, J.-L.
Deposit date:2002-07-15
Release date:2002-08-07
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:The NMR structure of [Xd(C2)]4 investigated by molecular dynamics simulations
MAGN.RESON.CHEM., 41, 2003
7LDU
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BU of 7ldu by Molmil
Zoogloea ramigera biosynthetic thiolase Q183Y/Y218E/delH221 mutant
Descriptor: Acetyl-CoA acetyltransferase, CHLORIDE ION, COENZYME A, ...
Authors:Marshall, A.C, Bruning, J.B.
Deposit date:2021-01-14
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Engineering potassium activation into biosynthetic thiolase.
Biochem.J., 478, 2021
1M6D
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BU of 1m6d by Molmil
Crystal structure of human cathepsin F
Descriptor: 4-MORPHOLIN-4-YL-PIPERIDINE-1-CARBOXYLIC ACID [1-(3-BENZENESULFONYL-1-PROPYL-ALLYLCARBAMOYL)-2-PHENYLETHYL]-AMIDE, Cathepsin F
Authors:Somoza, J.R, Palmer, J.T, Ho, J.D.
Deposit date:2002-07-15
Release date:2003-07-15
Last modified:2021-10-27
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The crystal structure of human cathepsin F and its implications for the development of novel immunomodulators
J.Mol.Biol., 322, 2002
7LDC
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BU of 7ldc by Molmil
Zoogloea ramigera biosynthetic thiolase Q183Y/Y218E mutant
Descriptor: Acetyl-CoA acetyltransferase, COENZYME A, SULFATE ION
Authors:Marshall, A.C, Bruning, J.B.
Deposit date:2021-01-13
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Engineering potassium activation into biosynthetic thiolase.
Biochem.J., 478, 2021
7LDW
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BU of 7ldw by Molmil
Zoogloea ramigera biosynthetic thiolase Q183Y/Y218E/delH221/S227K/G248T mutant
Descriptor: AMMONIUM ION, Acetyl-CoA acetyltransferase, COENZYME A, ...
Authors:Marshall, A.C, Bruning, J.B.
Deposit date:2021-01-14
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Engineering potassium activation into biosynthetic thiolase.
Biochem.J., 478, 2021
7LY1
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BU of 7ly1 by Molmil
Crystal structure of Pseudomonas aeruginosa PBP3 in complex with vaborbactam
Descriptor: Peptidoglycan D,D-transpeptidase FtsI, Vaborbactam
Authors:van den Akker, F, Kumar, V.
Deposit date:2021-03-05
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural analysis of the boronic acid beta-lactamase inhibitor vaborbactam binding to Pseudomonas aeruginosa penicillin-binding protein 3.
Plos One, 16, 2021
8SJR
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BU of 8sjr by Molmil
[3T17] Self-assembling right-handed tensegrity triangle with 17 interjunction base pairs and R3 symmetry
Descriptor: DNA (5'-D(*CP*AP*GP*CP*AP*GP*CP*CP*TP*GP*AP*AP*TP*AP*CP*CP*GP*CP*A)-3'), DNA (5'-D(*TP*GP*CP*GP*CP*TP*GP*TP*GP*GP*CP*TP*GP*C)-3'), DNA (5'-D(P*GP*CP*GP*GP*TP*AP*TP*TP*CP*AP*CP*CP*AP*CP*GP*AP*T)-3'), ...
Authors:Janowski, J, Vecchioni, S, Sha, R, Ohayon, Y.P.
Deposit date:2023-04-18
Release date:2024-04-24
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (5.25 Å)
Cite:Engineering tertiary chirality in helical biopolymers.
Proc.Natl.Acad.Sci.USA, 121, 2024
2XBQ
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BU of 2xbq by Molmil
Crystal structure of reduced Schistosoma mansoni Thioredoxin pre- protein at 1.7 Angstrom
Descriptor: THIOREDOXIN, ZINC ION
Authors:Boumis, G, Miele, A.E, Dimastrogiovanni, D, Angelucci, F, Bellelli, A.
Deposit date:2010-04-14
Release date:2010-07-21
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Structural and Functional Characterization of Schistosoma Mansoni Thioredoxin.
Protein Sci., 20, 2011
2XCD
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BU of 2xcd by Molmil
Structure of YncF,the genomic dUTPase from Bacillus subtilis
Descriptor: CHLORIDE ION, GLYCEROL, MAGNESIUM ION, ...
Authors:Garcia, J, Burchell, L, Takezawa, M, Rzechorzek, N.J, Fogg, M, Wilson, K.S.
Deposit date:2010-04-22
Release date:2010-08-11
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:The Structure of the Genomic Bacillus Subtilis Dutpase: Novel Features in the Phe-Lid.
Acta Crystallogr.,Sect.D, 66, 2010
7LPO
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BU of 7lpo by Molmil
Crystal structure of Cryptococcus neoformans sterylglucosidase 1 with tris
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Cytoplasmic protein, MAGNESIUM ION
Authors:Pereira de Sa, N, Del Poeta, M, Airola, M.V.
Deposit date:2021-02-12
Release date:2021-09-01
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:Structure and inhibition of Cryptococcus neoformans sterylglucosidase to develop antifungal agents.
Nat Commun, 12, 2021
1M70
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BU of 1m70 by Molmil
Crystal structure of oxidized recombinant cytochrome c4 from Pseudomonas stutzeri
Descriptor: Cytochrome c4, GLYCEROL, HEME C
Authors:Noergaard, A, Harris, P, Larsen, S, Christensen, H.E.M.
Deposit date:2002-07-18
Release date:2003-09-16
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Structural comparison of recombinant Pseudomonas stutzeri cytochrome c4 in two oxidation states
To be Published
8SJU
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BU of 8sju by Molmil
[4T17] Self-assembling right-handed four-turn tensegrity triangle with 17 interjunction base pairs and R3 symmetry
Descriptor: DNA (25-MER), DNA (5'-D(*GP*AP*AP*AP*AP*AP*CP*AP*CP*TP*GP*CP*CP*TP*GP*AP*AP*TP*AP*CP*CP*GP*CP*A)-3'), DNA (5'-D(P*GP*CP*GP*GP*TP*AP*TP*TP*CP*AP*CP*CP*AP*CP*GP*AP*T)-3'), ...
Authors:Janowski, J, Vecchioni, S, Sha, R, Ohayon, Y.P.
Deposit date:2023-04-18
Release date:2024-04-24
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (7.14 Å)
Cite:Engineering tertiary chirality in helical biopolymers.
Proc.Natl.Acad.Sci.USA, 121, 2024
5VE8
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BU of 5ve8 by Molmil
Crystal structure of full-length Kluyveromyces lactis Kap123 with histone H3 1-28
Descriptor: Histone H3, Kap123
Authors:An, S, Yoon, J, Song, J.-J, Cho, U.-S.
Deposit date:2017-04-04
Release date:2017-11-01
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure-based nuclear import mechanism of histones H3 and H4 mediated by Kap123.
Elife, 6, 2017
7LCA
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BU of 7lca by Molmil
Zoogloea ramigera biosynthetic thiolase Y218E/delH221 mutant
Descriptor: Acetyl-CoA acetyltransferase, CHLORIDE ION, COENZYME A, ...
Authors:Marshall, A.C, Bruning, J.B.
Deposit date:2021-01-10
Release date:2021-09-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Engineering potassium activation into biosynthetic thiolase.
Biochem.J., 478, 2021
1M8G
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BU of 1m8g by Molmil
Crystal Structure Of Methanobacterium Thermoautotrophicum Nicotinamide Mononucleotide Adenylyltransferase Mutant R11K complexed with NAD
Descriptor: NICOTINAMIDE-ADENINE-DINUCLEOTIDE, Nicotinamide-nucleotide Adenylyltransferase
Authors:Saridakis, V, Pai, E.F.
Deposit date:2002-07-24
Release date:2003-07-15
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2 Å)
Cite:Mutational, Structural, and Kinetic Studies of the ATP-binding Site of Methanobacterium thermoautotrophicum Nicotinamide Mononucleotide Adenylyltransferase
J.Biol.Chem., 278, 2003
7LPP
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BU of 7lpp by Molmil
Crystal structure of Cryptococcus neoformans sterylglucosidase 1 with hit 1
Descriptor: 4-(hydroxymethyl)-1-[[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methyl]piperidin-4-ol, Cytoplasmic protein, GLYCEROL, ...
Authors:Pereira de Sa, N, Del Poeta, M, Airola, M.V.
Deposit date:2021-02-12
Release date:2021-09-01
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Structure and inhibition of Cryptococcus neoformans sterylglucosidase to develop antifungal agents.
Nat Commun, 12, 2021
5VFF
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BU of 5vff by Molmil
Synaptotagmin 1 C2B domain, lead-bound (low occupancy)
Descriptor: LEAD (II) ION, Synaptotagmin-1
Authors:Taylor, A.B, Hart, P.J, Igumenova, T.I.
Deposit date:2017-04-07
Release date:2018-04-11
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.413 Å)
Cite:High affinity interactions of Pb2+with synaptotagmin I.
Metallomics, 10, 2018

222415

數據於2024-07-10公開中

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