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5MQT
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BU of 5mqt by Molmil
Crystal structure of dCK mutant C3S in complex with imatinib and UDP
分子名称: 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE, 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE, Deoxycytidine kinase, ...
著者Saez-Ayala, M, Rebuffet, E, Hammam, K, Gros, L, Lopez, S, Hajem, B, Humbert, M, Baudelet, E, Audebert, S, Betzi, S, Lugari, A, Combes, S, Pez, D, Letard, S, Mansfield, C, Moussy, A, de Sepulveda, P, Morelli, X, Dubreuil, P.
登録日2016-12-20
公開日2017-11-22
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Dual protein kinase and nucleoside kinase modulators for rationally designed polypharmacology.
Nat Commun, 8, 2017
4C40
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BU of 4c40 by Molmil
The molecular recognition of kink turn structure by the L7Ae class of proteins
分子名称: 5'-(*GP*GP*CP*GP*AP*AP*GP*AP*AP*CP*CP*GP*GP*GP *GP*AP*GP*CP*C)-3'
著者Huang, L, Lilley, D.M.J.
登録日2013-08-28
公開日2013-11-06
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献The Molecular Recognition of Kink-Turn Structure by the L7Ae Class of Proteins.
RNA, 19, 2013
5MR5
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BU of 5mr5 by Molmil
Ligand-receptor complex.
分子名称: GDNF family receptor alpha-2, GLYCEROL, Neurturin, ...
著者Sandmark, J, Oster, L, Aagaard, A, Roth, R, Dahl, G.
登録日2016-12-21
公開日2018-01-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure and biophysical characterization of the human full-length neurturin-GFRa2 complex: A role for heparan sulfate in signaling.
J. Biol. Chem., 293, 2018
5YR3
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BU of 5yr3 by Molmil
Structure of sfYFP66BPA
分子名称: Yellow fluorescent protein
著者Kang, F, Wang, L, Wang, J.
登録日2017-11-08
公開日2019-01-30
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.901 Å)
主引用文献sfYFP66BPA
To Be Published
4C45
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BU of 4c45 by Molmil
Crystal structure of human pterin-4-alpha-carbinolamine dehydratase 2 (PCBD2)
分子名称: 1,2-ETHANEDIOL, PTERIN-4-ALPHA-CARBINOLAMINE DEHYDRATASE 2
著者Kopec, J, Kiyani, W, Vollmar, M, Shrestha, L, Canning, P, von Delft, F, Burgess-Brown, N, Bountra, C, Arrowsmith, C.H, Edwards, A, Yue, W.W.
登録日2013-08-30
公開日2013-09-11
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Crystal Structure of Human Pterin-4-Alpha- Carbinolamine Dehydratase 2 (Pcbd2)
To be Published
5XYY
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BU of 5xyy by Molmil
The structure of p38 alpha in complex with a triazol inhibitor
分子名称: 3-(5-{[(2-chloro-6-fluorophenyl)methyl]amino}-4H-1,2,4-triazol-3-yl)phenol, Mitogen-activated protein kinase 14
著者Wang, Y.L, Sun, Y.Z, Cao, R, Liu, D, Li, L, Qi, X.B, Huang, N.
登録日2017-07-11
公開日2018-01-17
最終更新日2024-04-10
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献In Silico Identification of a Novel Hinge-Binding Scaffold for Kinase Inhibitor Discovery.
J. Med. Chem., 60, 2017
6F47
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BU of 6f47 by Molmil
Crystal structure of the catalytic domain of botulinum neurotoxin X
分子名称: Catalytic domain of botulinum neurotoxin X, ZINC ION
著者Masuyer, G, Henriksson, L, Kosenina, S, Zhang, S, Barkho, S, Shen, Y, Dong, M, Stenmark, P.
登録日2017-11-29
公開日2018-03-14
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Structural characterisation of the catalytic domain of botulinum neurotoxin X - high activity and unique substrate specificity.
Sci Rep, 8, 2018
5MK4
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BU of 5mk4 by Molmil
Crystal structure of the Retinoid X Receptor alpha in complex with synthetic honokiol derivative 7 and a fragment of the TIF2 co-activator.
分子名称: (~{E})-3-[3-(2-methyl-5-phenyl-phenyl)-4-oxidanyl-phenyl]prop-2-enoic acid, CHLORIDE ION, Nuclear receptor coactivator 2, ...
著者Andrei, S.A, Scheepstra, M, Brunsveld, L, Ottmann, C.
登録日2016-12-02
公開日2017-11-08
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Ligand Dependent Switch from RXR Homo- to RXR-NURR1 Heterodimerization.
ACS Chem Neurosci, 8, 2017
3T95
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BU of 3t95 by Molmil
Crystal structure of LsrB from Yersinia pestis complexed with autoinducer-2
分子名称: (2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran, Autoinducer 2-binding protein lsrB
著者Kavanaugh, J.S, Gakhar, L, Horswill, A.R.
登録日2011-08-02
公開日2011-12-07
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献The structure of LsrB from Yersinia pestis complexed with autoinducer-2.
Acta Crystallogr.,Sect.F, 67, 2011
4C06
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BU of 4c06 by Molmil
Crystal structure of M. musculus protein arginine methyltransferase PRMT6 with MgCl2
分子名称: MAGNESIUM ION, PROTEIN ARGININE N-METHYLTRANSFERASE 6
著者Bonnefond, L, Cura, V, Troffer-Charlier, N, Mailliot, J, Wurtz, J.M, Cavarelli, J.
登録日2013-07-31
公開日2014-07-30
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Functional Insights from High Resolution Structures of Mouse Protein Arginine Methyltransferase 6.
J.Struct.Biol., 191, 2015
1OEX
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BU of 1oex by Molmil
Atomic Resolution Structure of Endothiapepsin in Complex with a Hydroxyethylene Transition State Analogue Inhibitor H261
分子名称: ENDOTHIAPEPSIN, GLYCEROL, INHIBITOR H261, ...
著者Coates, L, Erskine, P.T, Mall, S, Gill, R.S, Wood, S.P, Myles, D.A.A, Cooper, J.B.
登録日2003-03-31
公開日2003-04-02
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Atomic Resolution Analysis of the Catalytic Site of an Aspartic Proteinase and an Unexpected Mode of Binding by Short Peptides
Protein Sci., 12, 2003
1F4N
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BU of 1f4n by Molmil
C2 CRYSTAL STRUCTURE OF ALA2ILE2-6, A VERSION OF ROP WITH A REPACKED HYDROPHOBIC CORE AND A NEW FOLD.
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, CALCIUM ION, ROP ALA2ILE2-6
著者Willis, M.A, Bishop, B, Regan, L, Brunger, A.T.
登録日2000-06-08
公開日2001-01-10
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Dramatic structural and thermodynamic consequences of repacking a protein's hydrophobic core.
Structure Fold.Des., 8, 2000
8B64
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BU of 8b64 by Molmil
Cryo-EM structure of RC-LH1-PufX photosynthetic core complex from Rba. capsulatus
分子名称: 1,2-Distearoyl-sn-glycerophosphoethanolamine, BACTERIOCHLOROPHYLL A, BACTERIOPHEOPHYTIN A, ...
著者Bracun, L, Yamagata, A, Shirouzu, M, Liu, L.N.
登録日2022-09-26
公開日2023-02-01
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (2.589 Å)
主引用文献Cryo-EM structure of a monomeric RC-LH1-PufX supercomplex with high-carotenoid content from Rhodobacter capsulatus.
Structure, 31, 2023
1EZK
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BU of 1ezk by Molmil
Crystal structure of recombinant tryparedoxin I
分子名称: TRYPAREDOXIN I
著者Hofmann, B, Guerrero, S.A, Kalisz, H.M, Menge, U, Nogoceke, E, Montemartini, M, Singh, M, Flohe, L, Hecht, H.J.
登録日2000-05-11
公開日2000-05-24
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structures of tryparedoxins revealing interaction with trypanothione.
Biol.Chem., 382, 2001
6EWK
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BU of 6ewk by Molmil
T. californica AChE in complex with a 3-hydroxy-2-pyridine aldoxime.
分子名称: 2-[(~{E})-hydroxyiminomethyl]-6-(5-morpholin-4-ylpentyl)pyridin-3-ol, 2-acetamido-2-deoxy-beta-D-glucopyranose, Acetylcholinesterase, ...
著者de la Mora, E, Weik, M, Braiki, A, Mougeot, R, Jean, L, Renard, P.I.
登録日2017-11-04
公開日2018-11-14
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Potent 3-Hydroxy-2-Pyridine Aldoxime Reactivators of Organophosphate-Inhibited Cholinesterases with Predicted Blood-Brain Barrier Penetration.
Chemistry, 24, 2018
1OEW
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BU of 1oew by Molmil
ATOMIC RESOLUTION STRUCTURE OF NATIVE ENDOTHIAPEPSIN
分子名称: ENDOTHIAPEPSIN, GLYCEROL, SERINE, ...
著者Coates, L, Erskine, P.T, Mall, S, Gill, R.S, Wood, S.P, Myles, D.A.A, Cooper, J.B.
登録日2003-03-31
公開日2003-04-02
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (0.9 Å)
主引用文献Atomic Resolution Analysis of the Catalytic Site of an Aspartic Proteinase and an Unexpected Mode of Binding by Short Peptides
Protein Sci., 12, 2003
4CAY
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BU of 4cay by Molmil
Crystal structure of a human Anp32e-H2A.Z-H2B complex
分子名称: ACIDIC LEUCINE-RICH NUCLEAR PHOSPHOPROTEIN 32 FAMILY MEMBER E, HISTONE H2A.Z, HISTONE H2B TYPE 1-J
著者Obri, A, Ouararhni, K, Papin, C, Diebold, M.-L, Padmanabhan, K, Marek, M, Stoll, I, Roy, L, Reilly, P.T, Mak, T.W, Dimitrov, S, Romier, C, Hamiche, A.
登録日2013-10-09
公開日2014-01-22
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Anp32E is a Histone Chaperone that Removes H2A.Z from Chromatin
Nature, 648, 2014
1F1X
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BU of 1f1x by Molmil
CRYSTAL STRUCTURE OF HOMOPROTOCATECHUATE 2,3-DIOXYGENASE FROM BREVIBACTERIUM FUSCUM
分子名称: HOMOPROTOCATECHUATE 2,3-DIOXYGENASE, HYDRATED FE
著者Vetting, M.W, Lipscomb, J.D, Wackett, L.P, Que Jr, L, Ohlendorf, D.H.
登録日2000-05-20
公開日2003-06-10
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystallographic comparison of manganese- and iron-dependent homoprotocatechuate 2,3-dioxygenases.
J.Bacteriol., 186, 2004
4BUD
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BU of 4bud by Molmil
Crystal structure of human tankyrase 2 in complex with 2-(4-tert- butylphenyl)-1,4-dihydroquinazolin-4-one
分子名称: 2-(4-tert-butylphenyl)-1,4-dihydroquinazolin-4-one, GLYCEROL, SULFATE ION, ...
著者Haikarainen, T, Narwal, M, Lehtio, L.
登録日2013-06-20
公開日2013-10-30
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Para-Substituted 2-Phenyl-3,4-Dihydroquinazolin-4-Ones as Potent and Selective Tankyrase Inhibitors.
Chemmedchem, 8, 2013
3ST9
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BU of 3st9 by Molmil
Crystal structure of ClpP in heptameric form from Staphylococcus aureus
分子名称: ATP-dependent Clp protease proteolytic subunit, CALCIUM ION, GLYCEROL, ...
著者Zhang, J, Ye, F, Lan, L, Jiang, H, Luo, C, Yang, C.-G.
登録日2011-07-09
公開日2011-09-07
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Structural switching of Staphylococcus aureus Clp protease: a key to understanding protease dynamics
J.Biol.Chem., 286, 2011
1F08
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BU of 1f08 by Molmil
CRYSTAL STRUCTURE OF THE DNA-BINDING DOMAIN OF THE REPLICATION INITIATION PROTEIN E1 FROM PAPILLOMAVIRUS
分子名称: BROMIDE ION, REPLICATION PROTEIN E1
著者Enemark, E.J, Chen, G, Vaughn, D.E, Stenlund, A, Joshua-Tor, L.
登録日2000-05-15
公開日2001-05-16
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of the DNA binding domain of the replication initiation protein E1 from papillomavirus.
Mol.Cell, 6, 2000
5MPW
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BU of 5mpw by Molmil
Crystal structure of Arabidopsis thaliana RNA editing factor MORF1
分子名称: BROMIDE ION, Multiple organellar RNA editing factor 1, mitochondrial, ...
著者Haag, S, Schindler, M, Berndt, L, Brennicke, A, Takenaka, M, Weber, G.
登録日2016-12-19
公開日2017-02-22
最終更新日2017-12-27
実験手法X-RAY DIFFRACTION (1.499 Å)
主引用文献Crystal structures of the Arabidopsis thaliana organellar RNA editing factors MORF1 and MORF9.
Nucleic Acids Res., 45, 2017
3SWM
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BU of 3swm by Molmil
The NAC domain of ANAC019 in complex with DNA, gold derivative
分子名称: GOLD ION, NAC domain-containing protein 19, oligonucleotide forward, ...
著者Welner, D, Lo Leggio, L.
登録日2011-07-14
公開日2012-04-11
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (4.25 Å)
主引用文献DNA binding by the plant-specific NAC transcription factors in crystal and solution: a firm link to WRKY and GCM transcription factors.
Biochem.J., 444, 2012
6F1Z
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BU of 6f1z by Molmil
Roadblock-1 region of the dynein tail/dynactin/BICDR1 complex
分子名称: Cytoplasmic dynein 1 intermediate chain 2, Dynein light chain roadblock-type 1
著者Urnavicius, L, Lau, C.K, Elshenawy, M.M, Morales-Rios, E, Motz, C, Yildiz, A, Carter, A.P.
登録日2017-11-23
公開日2018-01-17
最終更新日2024-05-15
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Cryo-EM shows how dynactin recruits two dyneins for faster movement.
Nature, 554, 2018
1OXC
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BU of 1oxc by Molmil
LecB (PA-LII) in complex with FUCOSE
分子名称: CALCIUM ION, SULFATE ION, alpha-L-fucopyranose, ...
著者Loris, R, Tielker, D, Jaeger, K.-E, Wyns, L.
登録日2003-04-02
公開日2003-09-09
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Structural Basis of Carbohydrate Recognition by the Lectin LecB from Pseudomonas aeruginosa
J.MOL.BIOL., 331, 2003

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