5TJO
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![BU of 5tjo by Molmil](/molmil-images/mine/5tjo) | Crystal structure of GTB + B trisaccharide (mercury derivative) | Descriptor: | Histo-blood group ABO system transferase, MERCURY (II) ION, alpha-L-fucopyranose-(1-2)-[alpha-D-galactopyranose-(1-3)]octyl beta-D-galactopyranoside | Authors: | Legg, M.S.G, Gagnon, S.M.L, Evans, S.V. | Deposit date: | 2016-10-04 | Release date: | 2017-06-14 | Last modified: | 2023-10-04 | Method: | X-RAY DIFFRACTION (1.57 Å) | Cite: | High-resolution crystal structures and STD NMR mapping of human ABO(H) blood group glycosyltransferases in complex with trisaccharide reaction products suggest a molecular basis for product release. Glycobiology, 27, 2017
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5TJN
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![BU of 5tjn by Molmil](/molmil-images/mine/5tjn) | Crystal structure of GTB + B trisaccharide (native) | Descriptor: | (4S)-2-METHYL-2,4-PENTANEDIOL, Histo-blood group ABO system transferase, alpha-L-fucopyranose-(1-2)-[alpha-D-galactopyranose-(1-3)]octyl beta-D-galactopyranoside | Authors: | Legg, M.S.G, Gagnon, S.M.L, Evans, S.V. | Deposit date: | 2016-10-04 | Release date: | 2017-06-14 | Last modified: | 2023-10-04 | Method: | X-RAY DIFFRACTION (1.47 Å) | Cite: | High-resolution crystal structures and STD NMR mapping of human ABO(H) blood group glycosyltransferases in complex with trisaccharide reaction products suggest a molecular basis for product release. Glycobiology, 27, 2017
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7VQI
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![BU of 7vqi by Molmil](/molmil-images/mine/7vqi) | |
5UI6
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![BU of 5ui6 by Molmil](/molmil-images/mine/5ui6) | Solution NMR Structure of Lasso Peptide Acinetodin | Descriptor: | Acinetodin | Authors: | Bushin, L.B, Metelev, M, Severinov, K, Seyedsayamdost, M.R. | Deposit date: | 2017-01-12 | Release date: | 2017-02-08 | Last modified: | 2024-05-15 | Method: | SOLUTION NMR | Cite: | Acinetodin and Klebsidin, RNA Polymerase Targeting Lasso Peptides Produced by Human Isolates of Acinetobacter gyllenbergii and Klebsiella pneumoniae. ACS Chem. Biol., 12, 2017
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5UI7
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![BU of 5ui7 by Molmil](/molmil-images/mine/5ui7) | Solution NMR Structure of Lasso Peptide Klebsidin | Descriptor: | Klebsidin | Authors: | Bushin, L.B, Metelev, M, Severinov, K, Seyedsayamdost, M.R. | Deposit date: | 2017-01-13 | Release date: | 2017-02-08 | Last modified: | 2024-05-15 | Method: | SOLUTION NMR | Cite: | Acinetodin and Klebsidin, RNA Polymerase Targeting Lasso Peptides Produced by Human Isolates of Acinetobacter gyllenbergii and Klebsiella pneumoniae. ACS Chem. Biol., 12, 2017
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1F40
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![BU of 1f40 by Molmil](/molmil-images/mine/1f40) | SOLUTION STRUCTURE OF FKBP12 COMPLEXED WITH GPI-1046, A NEUROTROPHIC LIGAND | Descriptor: | (2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3-DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE, FK506 BINDING PROTEIN (FKBP12) | Authors: | Sich, C, Improta, S, Cowley, D.J, Guenet, C, Merly, J.P, Teufel, M, Saudek, V. | Deposit date: | 2000-06-07 | Release date: | 2000-11-08 | Last modified: | 2024-05-22 | Method: | SOLUTION NMR | Cite: | Solution structure of a neurotrophic ligand bound to FKBP12 and its effects on protein dynamics. Eur.J.Biochem., 267, 2000
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1DEF
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![BU of 1def by Molmil](/molmil-images/mine/1def) | |
5J4E
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![BU of 5j4e by Molmil](/molmil-images/mine/5j4e) | |
5J3W
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![BU of 5j3w by Molmil](/molmil-images/mine/5j3w) | |
3NKK
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![BU of 3nkk by Molmil](/molmil-images/mine/3nkk) | Trypsin in complex with fluorine containing fragment | Descriptor: | 3-fluoro-4-methylbenzenecarboximidamide, CALCIUM ION, Cationic trypsin, ... | Authors: | Schiering, N, Vulpetti, A, Dalvit, C. | Deposit date: | 2010-06-20 | Release date: | 2010-11-10 | Last modified: | 2017-11-08 | Method: | X-RAY DIFFRACTION (1.12 Å) | Cite: | Combined use of computational chemistry, NMR screening, and X-ray crystallography for identification and characterization of fluorophilic protein environments. Proteins, 78, 2010
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3NK8
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![BU of 3nk8 by Molmil](/molmil-images/mine/3nk8) | Trypsin in complex with fluorine-containing fragment | Descriptor: | 4-(trifluoromethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[b]pyridin-2-one, CALCIUM ION, Cationic trypsin, ... | Authors: | Schiering, N, Vulpetti, A, Dalvit, C. | Deposit date: | 2010-06-18 | Release date: | 2010-11-10 | Last modified: | 2017-11-08 | Method: | X-RAY DIFFRACTION (1.15 Å) | Cite: | Combined use of computational chemistry, NMR screening, and X-ray crystallography for identification and characterization of fluorophilic protein environments. Proteins, 78, 2010
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5IE8
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![BU of 5ie8 by Molmil](/molmil-images/mine/5ie8) | |
5JS8
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![BU of 5js8 by Molmil](/molmil-images/mine/5js8) | Structural Model of a Protein alpha subunit in complex with GDP obtained with SAXS and NMR residual couplings | Descriptor: | Guanine nucleotide-binding protein G(i) subunit alpha-1 | Authors: | Goricanec, D, Stehle, R, Grigoriu, S, Wagner, G, Hagn, F. | Deposit date: | 2016-05-07 | Release date: | 2016-06-29 | Last modified: | 2024-06-19 | Method: | SOLUTION NMR | Cite: | Conformational dynamics of a G-protein alpha subunit is tightly regulated by nucleotide binding. Proc.Natl.Acad.Sci.USA, 113, 2016
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5JR0
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![BU of 5jr0 by Molmil](/molmil-images/mine/5jr0) | |
1G1N
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![BU of 1g1n by Molmil](/molmil-images/mine/1g1n) | NICKED DECAMER DNA WITH PEG6 TETHER, NMR, 30 STRUCTURES | Descriptor: | 5'-D(*GP*TP*CP*GP*C)-3', 5'-D(P*GP*CP*GP*AP*CP*AP*AP*CP*GP*C)-3', 5'-D(P*GP*CP*GP*TP*T)-3', ... | Authors: | Bocian, W, Kozerski, L, Mazurek, A.P, Kawecki, R. | Deposit date: | 2000-10-13 | Release date: | 2001-03-14 | Last modified: | 2024-05-22 | Method: | SOLUTION NMR | Cite: | A nicked duplex decamer DNA with a PEG(6) tether. Nucleic Acids Res., 29, 2001
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1CWX
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![BU of 1cwx by Molmil](/molmil-images/mine/1cwx) | SOLUTION STRUCTURE OF THE HEPATITIS C VIRUS N-TERMINAL CAPSID PROTEIN 2-45 [C-HCV(2-45)] | Descriptor: | HEPATITIS C VIRUS CAPSID PROTEIN | Authors: | Ladaviere, L, Deleage, G, Montserret, R, Dalbon, P, Jolivet, M, Penin, F. | Deposit date: | 1999-08-27 | Release date: | 1999-08-30 | Last modified: | 2024-05-22 | Method: | SOLUTION NMR | Cite: | Structural Analysis of the Immunodominant Antigenic Region of the Hepatitis C Virus Capsid Protein by NMR To be Published
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3P8O
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![BU of 3p8o by Molmil](/molmil-images/mine/3p8o) | Crystal structure of HCV NS3/NS4A protease complexed with des-bromine analogue of BI 201335 | Descriptor: | HCV non-structural protein 4A, HCV serine protease NS3, N-[(cyclopentyloxy)carbonyl]-3-methyl-L-valyl-(4R)-N-[(1R,2S)-1-carboxy-2-ethenylcyclopropyl]-4-[(7-methoxy-2-{2-[(2-methylpropanoyl)amino]-1,3-thiazol-4-yl}quinolin-4-yl)oxy]-L-prolinamide, ... | Authors: | Lemke, C.T. | Deposit date: | 2010-10-14 | Release date: | 2011-01-26 | Last modified: | 2017-11-08 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Combined X-ray, NMR, and kinetic analyses reveal uncommon binding characteristics of the hepatitis C virus NS3-NS4A protease inhibitor BI 201335. J.Biol.Chem., 286, 2011
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3P8N
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![BU of 3p8n by Molmil](/molmil-images/mine/3p8n) | Crystal structure of HCV NS3/NS4A protease complexed with BI 201335 | Descriptor: | HCV non-structural protein 4A, HCV serine protease NS3, N-[(cyclopentyloxy)carbonyl]-3-methyl-L-valyl-(4R)-4-[(8-bromo-7-methoxy-2-{2-[(2-methylpropanoyl)amino]-1,3-thiazol-4-yl}quinolin-4-yl)oxy]-N-[(1R,2S)-1-carboxy-2-ethenylcyclopropyl]-L-prolinamide, ... | Authors: | Lemke, C.T. | Deposit date: | 2010-10-14 | Release date: | 2011-01-26 | Last modified: | 2017-11-08 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Combined X-ray, NMR, and kinetic analyses reveal uncommon binding characteristics of the hepatitis C virus NS3-NS4A protease inhibitor BI 201335. J.Biol.Chem., 286, 2011
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1F78
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![BU of 1f78 by Molmil](/molmil-images/mine/1f78) | |
1F79
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![BU of 1f79 by Molmil](/molmil-images/mine/1f79) | |
1F7H
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![BU of 1f7h by Molmil](/molmil-images/mine/1f7h) | |
1F7F
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![BU of 1f7f by Molmil](/molmil-images/mine/1f7f) | |
1F7I
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![BU of 1f7i by Molmil](/molmil-images/mine/1f7i) | |
1HP8
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![BU of 1hp8 by Molmil](/molmil-images/mine/1hp8) | SOLUTION STRUCTURE OF HUMAN P8-MTCP1, A CYSTEINE-RICH PROTEIN ENCODED BY THE MTCP1 ONCOGENE,REVEALS A NEW ALPHA-HELICAL ASSEMBLY MOTIF, NMR, MINIMIZED AVERAGE STRUCTURE | Descriptor: | Cx9C motif-containing protein 4 | Authors: | Barthe, P, Chiche, L, Strub, M.P, Roumestand, C. | Deposit date: | 1997-08-26 | Release date: | 1998-03-04 | Last modified: | 2019-08-21 | Method: | SOLUTION NMR | Cite: | Solution structure of human p8MTCP1, a cysteine-rich protein encoded by the MTCP1 oncogene, reveals a new alpha-helical assembly motif. J.Mol.Biol., 274, 1997
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6WPV
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![BU of 6wpv by Molmil](/molmil-images/mine/6wpv) | |