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3V45
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BU of 3v45 by Molmil
Crystal Structure of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium Target OR130
分子名称: CHLORIDE ION, SODIUM ION, Serine hydrolase OSH55
著者Kuzin, A, Su, M, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Rajagopalan, S, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Baker, D, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2011-12-14
公開日2012-01-04
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
2RHB
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BU of 2rhb by Molmil
Crystal structure of Nsp15-H234A mutant- Hexamer in asymmetric unit
分子名称: Uridylate-specific endoribonuclease
著者Palaninathan, S, Bhardwaj, K, Alcantara, J.M.O, Guarino, L, Yi, L.L, Kao, C.C, Sacchettini, J.
登録日2007-10-08
公開日2007-11-27
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural and functional analyses of the severe acute respiratory syndrome coronavirus endoribonuclease Nsp15.
J.Biol.Chem., 283, 2008
5WKZ
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BU of 5wkz by Molmil
VH1-69 germline antibody predicted from CR6261
分子名称: Immunoglobulin heavy variable 1-69D,IgG H chain, Lambda-chain (AA -20 to 215), SULFATE ION
著者Lang, S, Lee, P.S.
登録日2017-07-25
公開日2018-08-01
最終更新日2019-12-11
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Anti-idiotypic antibody K1-18 engages VH1-69 precursor and affinity-matured, anti-stem antibodies through mimicry of the HA stem
To Be Published
6F1F
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BU of 6f1f by Molmil
The methylene thioacetal BPTI (Bovine Pancreatic Trypsin Inhibitor) mutant structure
分子名称: GLYCEROL, Pancreatic trypsin inhibitor, SULFATE ION
著者Lansky, S, Mousa, R, Metanis, N, Shoham, G.
登録日2017-11-21
公開日2018-07-18
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.716 Å)
主引用文献BPTI folding revisited: switching a disulfide into methylene thioacetal reveals a previously hidden path.
Chem Sci, 9, 2018
5WKO
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BU of 5wko by Molmil
Crystal structure of antibody 27F3 recognizing the HA from A/California/04/2009 (H1N1) influenza virus
分子名称: Antibody 27F3 heavy chain, Antibody 27F3 light chain, Hemagglutinin
著者Wilson, I.A, Lang, S, Zhu, X.
登録日2017-07-25
公開日2017-10-25
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (3.492 Å)
主引用文献Antibody 27F3 Broadly Targets Influenza A Group 1 and 2 Hemagglutinins through a Further Variation in VH1-69 Antibody Orientation on the HA Stem.
Cell Rep, 20, 2017
3T03
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BU of 3t03 by Molmil
Crystal structure of PPAR gamma ligand binding domain in complex with a novel partial agonist GQ-16
分子名称: (5Z)-5-(5-bromo-2-methoxybenzylidene)-3-(4-methylbenzyl)-1,3-thiazolidine-2,4-dione, Nuclear receptor coactivator 1, Peroxisome proliferator-activated receptor gamma
著者Rajagopalan, S, Webb, P, Baxter, J.D, Brennan, R.G, Phillips, K.J.
登録日2011-07-19
公開日2012-05-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献GQ-16, a novel peroxisome proliferator-activated receptor (PPAR gamma) ligand, promotes insulin sensitization without weight gain.
J.Biol.Chem., 287, 2012
4DRT
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BU of 4drt by Molmil
Three dimensional structure of de novo designed serine hydrolase OSH26, Northeast Structural Genomics Consortium (NESG) target OR89
分子名称: CHLORIDE ION, SODIUM ION, de novo designed serine hydrolase, ...
著者Kuzin, A, Su, M, Rajagopalan, S, Seetharaman, J, Sahdev, S, Xiao, R, Ciccosanti, C, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-02-17
公開日2012-04-18
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.002 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4EUO
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BU of 4euo by Molmil
Structure of Atu4243-GABA sensor
分子名称: ABC transporter, substrate binding protein (Polyamine), GAMMA-AMINO-BUTANOIC ACID, ...
著者Morera, S, Planamente, S.
登録日2012-04-25
公開日2012-11-21
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.28 Å)
主引用文献Structural basis for selective GABA binding in bacterial pathogens.
Mol.Microbiol., 86, 2012
4F2V
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BU of 4f2v by Molmil
Crystal Structure of de novo designed serine hydrolase, Northeast Structural Genomics Consortium (NESG) Target OR165
分子名称: DI(HYDROXYETHYL)ETHER, DODECYL-ALPHA-D-MALTOSIDE, De novo designed serine hydrolase
著者Kuzin, A, Lew, S, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Rajagopalan, S, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-05-08
公開日2012-05-30
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.493 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4EQ7
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BU of 4eq7 by Molmil
Structure of Atu4243-GABA receptor
分子名称: ABC transporter, substrate binding protein (Polyamine), GLYCEROL, ...
著者Morera, S, Planamente, S.
登録日2012-04-18
公開日2012-11-21
最終更新日2012-12-19
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Structural basis for selective GABA binding in bacterial pathogens.
Mol.Microbiol., 86, 2012
4ETK
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BU of 4etk by Molmil
Crystal Structure of E6A/L130D/A155H variant of de novo designed serine hydrolase, Northeast Structural Genomics Consortium (NESG) Target OR186
分子名称: De novo designed serine hydrolase, SODIUM ION
著者Kuzin, A, Su, M, Seetharaman, J, Kornhaber, K, Kornhaber, G, Rajagopalan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-04-24
公開日2012-06-13
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4ETJ
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BU of 4etj by Molmil
Crystal Structure of E6H variant of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium (NESG) Target OR185
分子名称: 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, CHLORIDE ION, ...
著者Kuzin, A, Su, M, Seetharaman, J, Kornhaber, K, Kornhaber, G, Rajagopalan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-04-24
公開日2012-06-13
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.203 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4ESS
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BU of 4ess by Molmil
Crystal Structure of E6D/L155R variant of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium (NESG) Target OR187
分子名称: OR187
著者Kuzin, A, Su, M, Seetharaman, J, Kornhaber, K, Kornhaber, G, Rajagopalan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-04-23
公開日2012-06-13
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.9971 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
6H3M
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BU of 6h3m by Molmil
The crystal structure of a human seleno-insulin analog
分子名称: Insulin
著者Lansky, S, Weil-Ktorza, O, Metanis, N, Shoham, G.
登録日2018-07-19
公開日2019-08-14
最終更新日2020-08-26
実験手法X-RAY DIFFRACTION (1.821 Å)
主引用文献Substitution of an Internal Disulfide Bridge with a Diselenide Enhances both Foldability and Stability of Human Insulin.
Chemistry, 25, 2019
5AER
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BU of 5aer by Molmil
Neuronal calcium sensor-1 (NCS-1)from Rattus norvegicus complex with D2 dopamine receptor peptide from Homo sapiens
分子名称: CALCIUM ION, D(2) DOPAMINE RECEPTOR, NEURONAL CALCIUM SENSOR 1, ...
著者Saleem, M, Karuppiah, V, Pandalaneni, S, Burgoyne, R, Derrick, J.P, Lian, L.Y.
登録日2015-01-08
公開日2015-02-18
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.19 Å)
主引用文献Neuronal Calcium Sensor-1 Binds the D2 Dopamine Receptor and G-Protein-Coupled Receptor Kinase 1 (Grk1) Peptides Using Different Modes of Interactions.
J.Biol.Chem., 290, 2015
5AEQ
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BU of 5aeq by Molmil
Neuronal calcium sensor (NCS-1)from Rattus norvegicus
分子名称: CALCIUM ION, NEURONAL CALCIUM SENSOR 1, SODIUM ION
著者Saleem, M, Karuppiah, V, Pandalaneni, S, Burgoyne, R, Derrick, J.P, Lian, L.Y.
登録日2015-01-08
公開日2015-02-18
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Neuronal Calcium Sensor-1 Binds the D2 Dopamine Receptor and G-Protein-Coupled Receptor Kinase 1 (Grk1) Peptides Using Different Modes of Interactions.
J.Biol.Chem., 290, 2015
5AFP
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BU of 5afp by Molmil
Neuronal calcium sensor-1 (NCS-1)from Rattus norvegicus complex with rhodopsin kinase peptide from Homo sapiens
分子名称: CALCIUM ION, NEURONAL CALCIUM SENSOR 1, RHODOPSIN KINASE, ...
著者Saleem, M, Karuppiah, V, Pandalaneni, S, Burgoyne, R, Derrick, J.P, Lian, L.Y.
登録日2015-01-23
公開日2015-03-18
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Neuronal Calcium Sensor-1 Binds the D2 Dopamine Receptor and G-Protein Coupled Receptor Kinase 1 (Grk1) Peptides Using Different Modes of Interactions.
J.Biol.Chem., 290, 2015
4E9D
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BU of 4e9d by Molmil
The structure of the polo-box domain (PBD) of polo-like kinase 1 (Plk1) in complex with 3-(1-benzothiophen-2-yl)propanoyl-derivatized DPPLHSpTA peptide
分子名称: 3-(1-benzothiophen-2-yl)propanoyl-derivatized DPPLHSpTA peptide, GLYCEROL, Serine/threonine-protein kinase PLK1
著者Sledz, P, Hyvonen, M, Lang, S, Stubbs, C.J, Abell, C.
登録日2012-03-21
公開日2012-10-10
最終更新日2012-12-12
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献High-throughput interrogation of ligand binding mode using a fluorescence-based assay.
Angew.Chem.Int.Ed.Engl., 51, 2012
4D0R
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BU of 4d0r by Molmil
Mtb InhA complex with Pyradizinone compound 1
分子名称: 4-(4-chlorophenoxy)-6-oxo-1-phenyl-1,6-dihydropyridazine-3-carboxamide, ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Read, J.A, Gingell, H, Madhavapeddi, P, Lange, S.
登録日2014-04-29
公開日2015-05-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献Pyridazinones: A Novel Scaffold with Excellent Physicochemical Properties and Safety Profile for a Clinically Validated Target of Mycobacterium Tuberculosis
To be Published
4D0S
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BU of 4d0s by Molmil
Mtb InhA complex with Pyradizinone compound 14
分子名称: 1-{4-[(acetylamino)methyl]phenyl}-4-(4-chlorophenoxy)-6-oxo-1,6-dihydropyridazine-3-carboxamide, ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], MAGNESIUM ION, ...
著者Read, J.A, Breed, J, Madhavapeddi, P, Lange, S.
登録日2014-04-29
公開日2015-05-20
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Pyridazinones: A Novel Scaffold with Excellent Physicochemical Properties and Safety Profile for a Clinically Validated Target of Mycobacterium Tuberculosis
To be Published
4UQZ
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BU of 4uqz by Molmil
Coevolution of the ATPase ClpV, the TssB-TssC Sheath and the Accessory HsiE Protein Distinguishes Two Type VI Secretion Classes
分子名称: ACETATE ION, HSIB1, HSIE1
著者Forster, A, Planamente, S, Manoli, E, Lossi, N.S, Freemont, P.S, Filloux, A.
登録日2014-06-25
公開日2014-10-22
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.599 Å)
主引用文献Coevolution of the ATPase Clpv, the Sheath Proteins Tssb and Tssc and the Accessory Protein Tagj/Hsie1 Distinguishes Type Vi Secretion Classes.
RNA, 20, 2014
1K1G
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BU of 1k1g by Molmil
STRUCTURAL BASIS FOR RECOGNITION OF THE INTRON BRANCH SITE RNA BY SPLICING FACTOR 1
分子名称: 5'-R(*UP*AP*UP*AP*CP*UP*AP*AP*CP*AP*A)-3', SF1-Bo isoform
著者Liu, Z, Luyten, I, Bottomley, M.J, Messias, A.C, Houngninou-Molango, S, Sprangers, R, Zanier, K, Kramer, A, Sattler, M.
登録日2001-09-25
公開日2001-11-07
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structural basis for recognition of the intron branch site RNA by splicing factor 1.
Science, 294, 2001
3MWP
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BU of 3mwp by Molmil
Nucleoprotein structure of lassa fever virus
分子名称: Nucleoprotein, ZINC ION
著者Qi, X, Lan, S, Wang, W, Schelde, L.M, Dong, H, Wallat, G, Liang, Y, Ly, H, Dong, C, Scottish Structural Proteomics Facility (SSPF)
登録日2010-05-06
公開日2010-12-01
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.795 Å)
主引用文献Cap binding and immune evasion revealed by Lassa nucleoprotein structure.
Nature, 468, 2010
3MX5
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BU of 3mx5 by Molmil
Lassa fever virus nucleoprotein complexed with UTP
分子名称: Nucleoprotein, URIDINE 5'-TRIPHOSPHATE, ZINC ION
著者Qi, X, Lan, S, Wang, W, Schelde, L.M, Dong, H, Wallat, G, Liang, Y, Ly, H, Dong, C, Scottish Structural Proteomics Facility (SSPF)
登録日2010-05-06
公開日2010-12-01
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.903 Å)
主引用文献Cap binding and immune evasion revealed by Lassa nucleoprotein structure.
Nature, 468, 2010
3MWT
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BU of 3mwt by Molmil
Crystal structure of Lassa fever virus nucleoprotein in complex with Mn2+
分子名称: MANGANESE (II) ION, Nucleoprotein, ZINC ION
著者Qi, X, Lan, S, Wang, W, Schelde, L.M, Dong, H, Wallat, G, Liang, Y, Ly, H, Dong, C, Scottish Structural Proteomics Facility (SSPF)
登録日2010-05-06
公開日2010-12-01
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.982 Å)
主引用文献Cap binding and immune evasion revealed by Lassa nucleoprotein structure.
Nature, 468, 2010

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