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7JYV
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BU of 7jyv by Molmil
Crystal Structure of HLA A*2402 in complex with YFSPIRVTF, an 9-mer influenza epitope
分子名称: Beta-2-microglobulin, MAGNESIUM ION, MHC class I antigen, ...
著者Gras, S, Nguyen, A.T, Szeto, C, Rossjohn, J.
登録日2020-09-01
公開日2021-04-14
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献CD8 + T cell landscape in Indigenous and non-Indigenous people restricted by influenza mortality-associated HLA-A*24:02 allomorph.
Nat Commun, 12, 2021
7JYU
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BU of 7jyu by Molmil
Crystal Structure of HLA-A*2402 in complex with IYFSPIRVTF, an 10-mer epitope from Influenza B virus
分子名称: Beta-2-microglobulin, MAGNESIUM ION, MHC class I antigen, ...
著者Nguyen, A.T, Szeto, C, Rossjohn, J, Gras, S.
登録日2020-09-01
公開日2021-04-14
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献CD8 + T cell landscape in Indigenous and non-Indigenous people restricted by influenza mortality-associated HLA-A*24:02 allomorph.
Nat Commun, 12, 2021
7JYW
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BU of 7jyw by Molmil
Crystal Structure of HLA A*2402 in complex with TYQWIIRNW, an 9-mer influenza epitope
分子名称: Beta-2-microglobulin, CALCIUM ION, MHC class I antigen, ...
著者Gras, S, Nguyen, A.T, Szeto, C, Rossjohn, J.
登録日2020-09-01
公開日2021-04-14
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献CD8 + T cell landscape in Indigenous and non-Indigenous people restricted by influenza mortality-associated HLA-A*24:02 allomorph.
Nat Commun, 12, 2021
7JYX
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BU of 7jyx by Molmil
Crystal Structure of HLA A*2402 in complex with TYQWIIRNWET, an 11-mer epitope from Influenza
分子名称: Beta-2-microglobulin, MHC class I antigen, PB2 peptide from Influenza, ...
著者Gras, S, Nguyen, A.T, Szeto, C, Rossjohn, J.
登録日2020-09-01
公開日2021-04-14
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献CD8 + T cell landscape in Indigenous and non-Indigenous people restricted by influenza mortality-associated HLA-A*24:02 allomorph.
Nat Commun, 12, 2021
7K0V
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BU of 7k0v by Molmil
Crystal structure of bRaf in complex with inhibitor GNE-0749
分子名称: CHLORIDE ION, N-(3,3-dimethylbutyl)-N'-{2-fluoro-5-[(5-fluoro-3-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)amino]-4-methylphenyl}urea, Non-specific serine/threonine protein kinase
著者Yin, J, Eigenbrot, C.E, Wang, W.
登録日2020-09-06
公開日2021-05-26
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Targeting KRAS Mutant Cancers via Combination Treatment: Discovery of a 5-Fluoro-4-(3 H )-quinazolinone Aryl Urea pan-RAF Kinase Inhibitor.
J.Med.Chem., 64, 2021
7USE
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BU of 7use by Molmil
Cryo-EM structure of WAVE regulatory complex with Rac1 bound on both A and D site
分子名称: Abl interactor 2, Cytoplasmic FMR1-interacting protein 1, GUANOSINE-5'-TRIPHOSPHATE, ...
著者Ding, B, Yang, S, Chen, B, Chowdhury, S.
登録日2022-04-25
公開日2022-09-21
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献Structures reveal a key mechanism of WAVE regulatory complex activation by Rac1 GTPase.
Nat Commun, 13, 2022
7USC
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BU of 7usc by Molmil
Cryo-EM structure of WAVE Regulatory Complex
分子名称: Abl interactor 2, Cytoplasmic FMR1-interacting protein 1, Nck-associated protein 1, ...
著者Ding, B, Yang, S, Chen, B, Chowdhury, S.
登録日2022-04-25
公開日2022-09-21
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献Structures reveal a key mechanism of WAVE regulatory complex activation by Rac1 GTPase.
Nat Commun, 13, 2022
7USD
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BU of 7usd by Molmil
Cryo-EM structure of D-site Rac1-bound WAVE Regulatory Complex
分子名称: Abl interactor 2, Cytoplasmic FMR1-interacting protein 1, GUANOSINE-5'-TRIPHOSPHATE, ...
著者Ding, B, Yang, S, Chen, B, Chowdhury, S.
登録日2022-04-25
公開日2022-09-21
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3 Å)
主引用文献Structures reveal a key mechanism of WAVE regulatory complex activation by Rac1 GTPase.
Nat Commun, 13, 2022
6SKA
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BU of 6ska by Molmil
Teneurin 2 in complex with Latrophilin 1 Lec-Olf domains
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Adhesion G protein-coupled receptor L1, ...
著者Chu, A, Carrasquero, M.A, Lowe, E, Seiradake, E.
登録日2019-08-15
公開日2020-02-12
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.86 Å)
主引用文献Structural Basis of Teneurin-Latrophilin Interaction in Repulsive Guidance of Migrating Neurons.
Cell, 180, 2020
6TBK
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BU of 6tbk by Molmil
Structure of a beta galactosidase with inhibitor
分子名称: 5-(dimethylamino)-~{N}-[6-[(2~{R},3~{R},4~{S},5~{R})-3-(hydroxymethyl)-4,5-bis(oxidanyl)piperidin-2-yl]hexyl]naphthalene-1-sulfonamide, Beta-galactosidase, putative, ...
著者Offen, W, Davies, G.
登録日2019-11-01
公開日2020-08-19
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Mechanistic Insights into the Chaperoning of Human Lysosomal-Galactosidase Activity: Highly Functionalized Aminocyclopentanes and C -5a-Substituted Derivatives of 4- epi -Isofagomine.
Molecules, 25, 2020
6T3Z
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BU of 6t3z by Molmil
Crystal structure of the truncated EBV BFRF1-BFLF2 nuclear egress complex
分子名称: MALONATE ION, Nuclear egress protein 2,Nuclear egress protein 1
著者Muller, Y.A.
登録日2019-10-11
公開日2020-02-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.55862784 Å)
主引用文献High-resolution crystal structures of two prototypical beta- and gamma-herpesviral nuclear egress complexes unravel the determinants of subfamily specificity.
J.Biol.Chem., 295, 2020
6THS
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BU of 6ths by Molmil
High resolution crystal structure of Leaf-branch cutinase S165A variant
分子名称: 1,4-DIETHYLENE DIOXIDE, LCC
著者Nomme, J.
登録日2019-11-21
公開日2020-04-22
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献An engineered PET depolymerase to break down and recycle plastic bottles.
Nature, 580, 2020
5KTU
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BU of 5ktu by Molmil
Crystal structure of the bromodomain of human CREBBP bound to pyrazolopiperidine scaffold
分子名称: 1-(3-phenylazanyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone, CREB-binding protein, DIMETHYL SULFOXIDE
著者Jayaram, H, Poy, F, Setser, J.W, Bellon, S.F.
登録日2016-07-12
公開日2016-11-02
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.38 Å)
主引用文献Discovery of a Potent and Selective in Vivo Probe (GNE-272) for the Bromodomains of CBP/EP300.
J. Med. Chem., 59, 2016
5WDO
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BU of 5wdo by Molmil
H-Ras bound to GMP-PNP at 277K
分子名称: CALCIUM ION, GTPase HRas, MAGNESIUM ION, ...
著者Cofsky, J.C, Bandaru, P, Gee, C.L, Kuriyan, J.
登録日2017-07-05
公開日2017-07-19
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Deconstruction of the Ras switching cycle through saturation mutagenesis.
Elife, 6, 2017
5CTM
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BU of 5ctm by Molmil
Structure of BPu1 beta-lactamase
分子名称: 1,2-ETHANEDIOL, Beta-lactamase, CITRATE ANION, ...
著者Smith, C.A, Vakulenko, S.B.
登録日2015-07-24
公開日2015-11-18
最終更新日2015-12-30
実験手法X-RAY DIFFRACTION (1 Å)
主引用文献Class D beta-lactamases do exist in Gram-positive bacteria.
Nat.Chem.Biol., 12, 2016
5EGS
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BU of 5egs by Molmil
Human PRMT6 with bound fragment-type inhibitor
分子名称: 2-[4-(phenylmethyl)piperidin-1-yl]ethanamine, Protein arginine N-methyltransferase 6, S-ADENOSYL-L-HOMOCYSTEINE
著者Steuber, H, Egner, U, Kania, J, Wu, H, Brown, P.J.
登録日2015-10-27
公開日2016-02-03
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Discovery of a Potent Class I Protein Arginine Methyltransferase Fragment Inhibitor.
J.Med.Chem., 59, 2016
7QBA
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BU of 7qba by Molmil
CryoEM structure of the ABC transporter NosDFY complexed with nitrous oxide reductase NosZ
分子名称: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, MAGNESIUM ION, ...
著者Zipfel, S, Mueller, C, Topitsch, A, Lutz, M, Zhang, L, Einsle, O.
登録日2021-11-18
公開日2022-08-03
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.78 Å)
主引用文献Molecular interplay of an assembly machinery for nitrous oxide reductase.
Nature, 608, 2022
8AFP
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BU of 8afp by Molmil
Structure of fibronectin 2 and 3 of L1CAM at 3.0 Angstrom
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Neural cell adhesion molecule L1
著者Guedez, G, Loew, C.
登録日2022-07-18
公開日2023-03-08
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献X-ray structure and function of fibronectin domains two and three of the neural cell adhesion molecule L1.
Faseb J., 37, 2023
5E8R
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BU of 5e8r by Molmil
Human HMT1 hnRNP methyltransferase-like protein 6 (S. cerevisiae)
分子名称: CHLORIDE ION, N-methyl-N-({4-[4-(propan-2-yloxy)phenyl]-1H-pyrrol-3-yl}methyl)ethane-1,2-diamine, Protein arginine N-methyltransferase 6, ...
著者DONG, A, ZENG, H, LIU, J, TEMPEL, W, Seitova, A, Hutchinson, A, Bountra, C, Arrowsmith, C.H, Edwards, A.M, JIN, J, BROWN, P.J, WU, H, Structural Genomics Consortium (SGC)
登録日2015-10-14
公開日2015-12-09
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献A Potent, Selective, and Cell-Active Inhibitor of Human Type I Protein Arginine Methyltransferases.
Acs Chem.Biol., 11, 2016
6TBJ
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BU of 6tbj by Molmil
Structure of a beta galactosidase with inhibitor
分子名称: 5-(dimethylamino)-~{N}-[6-[(2~{S},3~{R},4~{S},5~{R})-3-(hydroxymethyl)-4,5-bis(oxidanyl)piperidin-2-yl]hexyl]naphthalene-1-sulfonamide, Beta-galactosidase, putative, ...
著者Offen, W, Davies, G.
登録日2019-11-01
公開日2020-08-19
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Mechanistic Insights into the Chaperoning of Human Lysosomal-Galactosidase Activity: Highly Functionalized Aminocyclopentanes and C -5a-Substituted Derivatives of 4- epi -Isofagomine.
Molecules, 25, 2020
6TFI
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BU of 6tfi by Molmil
PXR IN COMPLEX WITH THROMBIN INHIBITOR COMPOUND 17
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, DIMETHYL SULFOXIDE, GLYCEROL, ...
著者Hillig, R.C, Puetter, V.
登録日2019-11-14
公開日2020-11-11
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Design, Synthesis, and Pharmacological Characterization of a Neutral, Non-Prodrug Thrombin Inhibitor with Good Oral Pharmacokinetics.
J.Med.Chem., 63, 2020
5D5N
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BU of 5d5n by Molmil
Crystal Structure of the Human Cytomegalovirus pUL50-pUL53 Complex
分子名称: Virion egress protein UL31 homolog, Virion egress protein UL34 homolog, ZINC ION
著者Walzer, S.A, Egerer-Sieber, C, Hohl, K, Sevvana, M, Muller, Y.A.
登録日2015-08-11
公開日2015-10-07
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Crystal Structure of the Human Cytomegalovirus pUL50-pUL53 Core Nuclear Egress Complex Provides Insight into a Unique Assembly Scaffold for Virus-Host Protein Interactions.
J.Biol.Chem., 290, 2015
6TDP
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BU of 6tdp by Molmil
Crystal structure of the disulfide engineered HLA-A0201 molecule in complex with one GL dipeptide in the A pocket.
分子名称: Beta-2-microglobulin, GLYCEROL, GLYCINE, ...
著者Anjanappa, R, Garcia Alai, M, Springer, S, Meijers, R.
登録日2019-11-10
公開日2020-03-25
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structures of peptide-free and partially loaded MHC class I molecules reveal mechanisms of peptide selection.
Nat Commun, 11, 2020
6TDR
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BU of 6tdr by Molmil
Crystal structure of the disulfide engineered HLA-A0201 molecule devoid of peptide (annealed)
分子名称: 1,2-ETHANEDIOL, Beta-2-microglobulin, MHC class I antigen, ...
著者Anjanappa, R, Garcia Alai, M, Springer, S, Meijers, R.
登録日2019-11-10
公開日2020-03-25
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structures of peptide-free and partially loaded MHC class I molecules reveal mechanisms of peptide selection.
Nat Commun, 11, 2020
5WDS
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BU of 5wds by Molmil
Choanoflagellate Salpingoeca rosetta Ras with GDP bound
分子名称: GLYCEROL, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
著者Kondo, Y, Gee, C.L, Kuriyan, J.
登録日2017-07-05
公開日2017-07-19
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Deconstruction of the Ras switching cycle through saturation mutagenesis.
Elife, 6, 2017

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