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4Y13
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BU of 4y13 by Molmil
SdiA in complex with octanoyl-rac-glycerol
Descriptor: (2S)-2,3-dihydroxypropyl octanoate, GLYCEROL, SULFATE ION, ...
Authors:Nguyen, N.X, Nguyen, Y, Sperandio, V, Jiang, Y.
Deposit date:2015-02-06
Release date:2015-04-08
Last modified:2019-12-04
Method:X-RAY DIFFRACTION (3.096 Å)
Cite:Structural and Mechanistic Roles of Novel Chemical Ligands on the SdiA Quorum-Sensing Transcription Regulator.
Mbio, 6, 2015
4IQT
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BU of 4iqt by Molmil
Tdt core in complex with inhibitor 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxohexa-2,5-dienoic acid
Descriptor: 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxohexa-2,5-dienoic acid, DNA nucleotidylexotransferase
Authors:Gouge, J, Delarue, M.
Deposit date:2013-01-13
Release date:2013-09-04
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:New nucleotide-competitive non-nucleoside inhibitors of terminal deoxynucleotidyl transferase: discovery, characterization, and crystal structure in complex with the target.
J.Med.Chem., 56, 2013
6B1G
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BU of 6b1g by Molmil
Solution structure of TDP-43 N-terminal domain dimer.
Descriptor: TAR DNA-binding protein 43, S48E Mutant, Y4R Mutant
Authors:Naik, M.T, Wang, A, Conicella, A, Fawzi, N.L.
Deposit date:2017-09-18
Release date:2018-02-28
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:A single N-terminal phosphomimic disrupts TDP-43 polymerization, phase separation, and RNA splicing.
EMBO J., 37, 2018
6M3I
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BU of 6m3i by Molmil
Crystal structure of HPF1/PARP1 complex
Descriptor: BENZAMIDE, Histone PARylation factor 1, Poly [ADP-ribose] polymerase 1
Authors:Sun, F.H, Yun, C.H.
Deposit date:2020-03-03
Release date:2021-03-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:HPF1 remodels the active site of PARP1 to enable the serine ADP-ribosylation of histones.
Nat Commun, 12, 2021
8K31
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BU of 8k31 by Molmil
The complex of WRKY33 C terminal DBD and SIB1
Descriptor: Probable WRKY transcription factor 33, Sigma factor binding protein 1, chloroplastic, ...
Authors:Dong, X, Gong, Z, Hu, Y.F.
Deposit date:2023-07-14
Release date:2024-06-19
Method:SOLUTION NMR
Cite:Structural basis for the regulation of plant transcription factor WRKY33 by the VQ protein SIB1.
Commun Biol, 7, 2024
8EFG
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BU of 8efg by Molmil
Crystal structure of human TATDN1 bound to dAMP and two zinc ions
Descriptor: (2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-tetrahydro-2-(hydroxymethyl)furan-3-ol, 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE, ADENINE, ...
Authors:Dorival, J, Eichman, B.F.
Deposit date:2022-09-08
Release date:2023-02-22
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Human and bacterial TatD enzymes exhibit apurinic/apyrimidinic (AP) endonuclease activity.
Nucleic Acids Res., 51, 2023
4RVK
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BU of 4rvk by Molmil
CHK1 kinase domain with diazacarbazole compound 8: N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide
Descriptor: N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide, Serine/threonine-protein kinase Chk1
Authors:Wiesmann, C, Wu, P.
Deposit date:2014-11-26
Release date:2015-06-03
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1.
J.Med.Chem., 58, 2015
1G18
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BU of 1g18 by Molmil
RECA-ADP-ALF4 COMPLEX
Descriptor: ADENOSINE-5'-DIPHOSPHATE, RECA PROTEIN, TETRAFLUOROALUMINATE ION
Authors:Datta, S, Prabu, M.M, Vaze, M.B, Ganesh, N, Chandra, N.R, Muniyappa, K, Vijayan, M, TB Structural Genomics Consortium (TBSGC)
Deposit date:2000-10-11
Release date:2000-12-11
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (3.8 Å)
Cite:Crystal structures of Mycobacterium tuberculosis RecA and its complex with ADP-AlF(4): implications for decreased ATPase activity and molecular aggregation
Nucleic Acids Res., 28, 2000
4RVM
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BU of 4rvm by Molmil
CHK1 kinase domain with diazacarbazole compound 19
Descriptor: 3-[4-(piperidin-1-ylmethyl)phenyl]-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile, Serine/threonine-protein kinase Chk1
Authors:Gazzard, L, Blackwood, E, Burton, B, Chapman, K, Chen, H, Crackett, P, Drobnick, J, Ellwood, C, Epler, J, Flagella, M, Goodacre, S, Halladay, J, Hunt, H, Kintz, S, Lyssikatos, J, MacLeod, C, Ramiscal, S, Schmidt, S, Seward, E, Wiesmann, C, Williams, K, Wu, P, Yee, S, Yen, I, Malek, S.
Deposit date:2014-11-26
Release date:2015-06-03
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1.
J.Med.Chem., 58, 2015
1VYM
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BU of 1vym by Molmil
NATIVE HUMAN PCNA
Descriptor: PROLIFERATING CELL NUCLEAR ANTIGEN
Authors:Kontopidis, G, Wu, S, Zheleva, D, Taylor, P, Mcinnes, C, Lane, D, Fischer, P, Walkinshaw, M.
Deposit date:2004-05-03
Release date:2005-01-13
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural and Biochemical Studies of Human Proliferating Cell Nuclear Antigen Complexes Provide a Rationale for Cyclin Association and Inhibitor Design
Proc.Natl.Acad.Sci.USA, 102, 2005
1VYJ
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BU of 1vyj by Molmil
Structural and biochemical studies of human PCNA complexes provide the basis for association with CDK/cyclin and rationale for inhibitor design
Descriptor: PROLIFERATING CELL NUCLEAR ANTIGEN, SMALL PEPTIDE SAVLQKKITDYFHPKK
Authors:Kontopidis, G, Wu, S, Zheleva, D, Taylor, P, Mcinnes, C, Lane, D, Fischer, P, Walkinshaw, M.D.
Deposit date:2004-04-30
Release date:2005-01-13
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural and Biochemical Studies of Human Proliferating Cell Nuclear Antigen Complexes Provide a Rationale for Cyclin Association and Inhibitor Design
Proc.Natl.Acad.Sci.USA, 102, 2005
8XOW
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BU of 8xow by Molmil
Mature virion portal of bacteriophage lambda
Descriptor: Head completion protein, Head-tail connector protein FII, Portal protein B, ...
Authors:Wang, J.W, Gu, Z.W.
Deposit date:2024-01-02
Release date:2024-04-10
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.32 Å)
Cite:Structural morphing in the viral portal vertex of bacteriophage lambda.
J.Virol., 98, 2024
8XOU
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BU of 8xou by Molmil
Prohead portal vertex of bacteriophage lambda
Descriptor: Major capsid protein, Portal protein B
Authors:Wang, J.W, Gu, Z.W.
Deposit date:2024-01-02
Release date:2024-04-10
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (5.58 Å)
Cite:Structural morphing in the viral portal vertex of bacteriophage lambda.
J.Virol., 98, 2024
8XOT
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BU of 8xot by Molmil
Prohead portal of bacteriophage lambda
Descriptor: Portal protein B
Authors:Wang, J.W, Gu, Z.W.
Deposit date:2024-01-02
Release date:2024-04-10
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.51 Å)
Cite:Structural morphing in the viral portal vertex of bacteriophage lambda.
J.Virol., 98, 2024
6NAO
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BU of 6nao by Molmil
Discovery of a high affinity inhibitor of cGAS
Descriptor: (1R,2S)-2-[(7-hydroxy-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid, CYCLIC GMP-AMP SYNTHASE, ZINC ION
Authors:Hall, J.
Deposit date:2018-12-06
Release date:2018-12-19
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (3.23 Å)
Cite:Discovery of PF-06928215 as a high affinity inhibitor of cGAS enabled by a novel fluorescence polarization assay.
PLoS ONE, 12, 2017
4RVL
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BU of 4rvl by Molmil
CHK1 kinase domain with diazacarbazole compound 7: 3-(2-hydroxyphenyl)-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile
Descriptor: 3-(2-hydroxyphenyl)-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile, Serine/threonine-protein kinase Chk1
Authors:Wiesmann, C, Wu, P.
Deposit date:2014-11-26
Release date:2015-06-03
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1.
J.Med.Chem., 58, 2015
1G19
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BU of 1g19 by Molmil
STRUCTURE OF RECA PROTEIN
Descriptor: PHOSPHATE ION, RECA PROTEIN
Authors:Datta, S, Prabu, M.M, Vaze, M.B, Ganesh, N, Chandra, N.R, Muniyappa, K, Vijayan, M, TB Structural Genomics Consortium (TBSGC)
Deposit date:2000-10-11
Release date:2000-12-11
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystal structures of Mycobacterium tuberculosis RecA and its complex with ADP-AlF(4): implications for decreased ATPase activity and molecular aggregation
Nucleic Acids Res., 28, 2000
6W1E
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BU of 6w1e by Molmil
Crystal structure of Streptococcus thermophilus SHP pheromone receptor Rgg3
Descriptor: Positive transcriptional regulator MutR family, SULFATE ION
Authors:Neiditch, M.B, Capodagli, G.C.
Deposit date:2020-03-04
Release date:2020-10-21
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.202 Å)
Cite:Structure-function studies of Rgg binding to pheromones and target promoters reveal a model of transcription factor interplay.
Proc.Natl.Acad.Sci.USA, 117, 2020
5Z30
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BU of 5z30 by Molmil
The crystal structure of the nucleosome containing a cancer-associated histone H2A.Z R80C mutant
Descriptor: CHLORIDE ION, DNA (146-MER), Histone H2A.Z, ...
Authors:Horikoshi, N, Arimura, Y, Kurumizaka, H.
Deposit date:2018-01-05
Release date:2018-07-18
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Cancer-associated mutations of histones H2B, H3.1 and H2A.Z.1 affect the structure and stability of the nucleosome.
Nucleic Acids Res., 46, 2018
1KN0
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BU of 1kn0 by Molmil
Crystal Structure of the human Rad52 protein
Descriptor: Rad52
Authors:Kagawa, W, Kurumizaka, H, Ishitani, R, Fukai, S, Nureki, O, Shibata, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2001-12-18
Release date:2002-09-04
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Crystal structure of the homologous-pairing domain from the human Rad52 recombinase in the undecameric form.
Mol.Cell, 10, 2002
6O7H
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BU of 6o7h by Molmil
Cryo-EM structure of Csm-crRNA-target RNA ternary complex in complex with cA4 in type III-A CRISPR-Cas system
Descriptor: CRISPR system single-strand-specific deoxyribonuclease Cas10/Csm1 (subtype III-A), Csm2, Csm3, ...
Authors:Jia, N, Patel, D.J.
Deposit date:2019-03-07
Release date:2019-07-31
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Second Messenger cA4Formation within the Composite Csm1 Palm Pocket of Type III-A CRISPR-Cas Csm Complex and Its Release Path.
Mol.Cell, 75, 2019
5WPA
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BU of 5wpa by Molmil
Structure of human SFPQ/PSPC1 heterodimer
Descriptor: Paraspeckle component 1, Splicing factor, proline- and glutamine-rich
Authors:Lee, M.
Deposit date:2017-08-04
Release date:2018-03-21
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Crystal structure of a SFPQ/PSPC1 heterodimer provides insights into preferential heterodimerization of human DBHS family proteins.
J. Biol. Chem., 293, 2018
8J4T
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BU of 8j4t by Molmil
GajA-GajB complex
Descriptor: Endonuclease GajA, Gabija protein GajB
Authors:Wei, T, Ma, J, Huo, Y.
Deposit date:2023-04-20
Release date:2024-02-21
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Structural and biochemical insights into the mechanism of the Gabija bacterial immunity system.
Nat Commun, 15, 2024
6OKB
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BU of 6okb by Molmil
Prohead 2 of the phage T5
Descriptor: Major capsid protein
Authors:Huet, A, Duda, R.L, Boulanger, P, Conway, J.F.
Deposit date:2019-04-12
Release date:2019-10-02
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (6.7 Å)
Cite:Capsid expansion of bacteriophage T5 revealed by high resolution cryoelectron microscopy.
Proc.Natl.Acad.Sci.USA, 116, 2019
5ECG
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BU of 5ecg by Molmil
Crystal structure of the BRCT domains of 53BP1 in complex with p53 and H2AX-pSer139 (gammaH2AX)
Descriptor: Cellular tumor antigen p53, SEP-GLN-GLU-TYR, Tumor suppressor p53-binding protein 1, ...
Authors:Day, M, Oliver, A.W, Pearl, L.H.
Deposit date:2015-10-20
Release date:2015-12-16
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (3 Å)
Cite:ATM Localization and Heterochromatin Repair Depend on Direct Interaction of the 53BP1-BRCT2 Domain with gamma H2AX.
Cell Rep, 13, 2015

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數據於2024-10-09公開中

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