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5TJO
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BU of 5tjo by Molmil
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
5TJN
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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
7VQI
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BU of 7vqi by Molmil
Solution NMR structure of Pseudomonas aeruginosa Lipopolysaccharide (LPS) Bicelle bound VR18 Antimicrobial Peptide
Descriptor: VAL-ALA-ARG-GLY-TRP-GLY-ARG-LYS-CYS-PRO-LEU-PHE-GLY-LYS-ASN-LYS-SER-ARG (VR18)
Authors:Mohid, S.A, Bhunia, A.
Deposit date:2021-10-20
Release date:2022-01-12
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:A rationally designed synthetic antimicrobial peptide against Pseudomonas-associated corneal keratitis: Structure-function correlation.
Biophys.Chem., 286, 2022
5UI6
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BU of 5ui6 by Molmil
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
5UI7
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BU of 5ui7 by Molmil
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
1F40
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BU of 1f40 by Molmil
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
1DEF
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BU of 1def by Molmil
PEPTIDE DEFORMYLASE CATALYTIC CORE (RESIDUES 1-147), NMR, 9 STRUCTURES
Descriptor: PEPTIDE DEFORMYLASE, ZINC ION
Authors:Meinnel, T, Dardel, F.
Deposit date:1996-03-19
Release date:1997-04-21
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:A new subclass of the zinc metalloproteases superfamily revealed by the solution structure of peptide deformylase.
J.Mol.Biol., 262, 1996
5J4E
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BU of 5j4e by Molmil
Crystal structures reveal signaling states of a short blue light photoreceptor protein PpSB1-LOV (Photoexcited state)
Descriptor: FLAVIN MONONUCLEOTIDE, Sensory box protein
Authors:Granzin, J, Batra-Safferling, R.
Deposit date:2016-04-01
Release date:2016-06-22
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.67 Å)
Cite:Signaling States of a Short Blue-Light Photoreceptor Protein PpSB1-LOV Revealed from Crystal Structures and Solution NMR Spectroscopy.
J.Mol.Biol., 428, 2016
5J3W
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BU of 5j3w by Molmil
Crystal structures reveal signaling states of a short blue light photoreceptor protein PpSB1-LOV (dark state)
Descriptor: FLAVIN MONONUCLEOTIDE, Sensory box protein
Authors:Granzin, J, Batra-Safferling, R.
Deposit date:2016-03-31
Release date:2016-06-22
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Signaling States of a Short Blue-Light Photoreceptor Protein PpSB1-LOV Revealed from Crystal Structures and Solution NMR Spectroscopy.
J.Mol.Biol., 428, 2016
3NKK
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BU of 3nkk by Molmil
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
3NK8
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BU of 3nk8 by Molmil
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
5IE8
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BU of 5ie8 by Molmil
The pyrazinoic acid binding domain of Ribosomal Protein S1 from Mycobacterium tuberculosis
Descriptor: 30S ribosomal protein S1
Authors:Huang, B, Liao, X.
Deposit date:2016-02-25
Release date:2016-03-16
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:(1)H, (15)N, (13)C resonance assignments for pyrazinoic acid binding domain of ribosomal protein S1 from Mycobacterium tuberculosis
Biomol NMR Assign, 10, 2016
5JS8
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BU of 5js8 by Molmil
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
5JR0
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BU of 5jr0 by Molmil
Domain 4 Segment 6 of voltage-gated sodium channel Nav1.4
Descriptor: Sodium channel protein type 4 subunit alpha
Authors:Niitsu, A, Egawa, A, Ikeda, K, Tachibana, K, Fujiwara, T.
Deposit date:2016-05-05
Release date:2017-05-17
Method:SOLID-STATE NMR
Cite:Veratridine binding to a transmembrane segment of mammalian sodium channel Nav1.4 determined by solid-state NMR
To Be Published
1G1N
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BU of 1g1n by Molmil
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
1CWX
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BU of 1cwx by Molmil
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
3P8O
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BU of 3p8o by Molmil
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
3P8N
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BU of 3p8n by Molmil
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
1F78
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BU of 1f78 by Molmil
SOLUTION STRUCTURE OF RNASE P RNA (M1 RNA) P4 STEM OLIGORIBONUCLEOTIDE COMPLEXED WITH COBALT (III) HEXAMINE, NMR, MINIMIZED AVERAGE STRUCTURE
Descriptor: COBALT HEXAMMINE(III), RNASE P RNA RIBOZYME, P4 DOMAIN
Authors:Schmitz, M, Tinoco Jr, I.
Deposit date:2000-06-26
Release date:2000-10-09
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and metal-ion binding of the P4 element from bacterial RNase P RNA.
RNA, 6, 2000
1F79
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BU of 1f79 by Molmil
SOLUTION STRUCTURE OF RNASE P RNA (M1 RNA) P4 STEM C70U MUTANT OLIGORIBONUCLEOTIDE COMPLEXED WITH COBALT(III) HEXAMMINE, NMR, MINIMIZED AVERAGE STRUCTURE
Descriptor: COBALT HEXAMMINE(III), RNASE P RNA RIBOZYME, P4 DOMAIN MUTANT
Authors:Schmitz, M, Tinoco Jr, I.
Deposit date:2000-06-23
Release date:2000-10-09
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and metal-ion binding of the P4 element from bacterial RNase P RNA.
RNA, 6, 2000
1F7H
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BU of 1f7h by Molmil
SOLUTION STRUCTURE OF THE RNASE P RNA (M1 RNA) P4 STEM OLIGORIBONUCLEOTIDE COMPLEXED WITH COBALT (III) HEXAMINE, NMR, ENSEMBLE OF 11 STRUCTURES
Descriptor: COBALT HEXAMMINE(III), RNASE P RNA RIBOZYME, P4 DOMAIN
Authors:Schmitz, M, Tinoco Jr, I.
Deposit date:2000-06-27
Release date:2000-10-09
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and metal-ion binding of the P4 element from bacterial RNase P RNA.
RNA, 6, 2000
1F7F
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BU of 1f7f by Molmil
SOLUTION STRUCTURE OF THE RNASE P RNA (M1 RNA) P4 STEM OLIGORIBONUCLEOTIDE, NMR, ENSEMBLE OF 9 STRUCTURES
Descriptor: RNASE P RNA RIBOZYME, P4 DOMAIN
Authors:Schmitz, M, Tinoco Jr, I.
Deposit date:2000-06-27
Release date:2000-10-09
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and metal-ion binding of the P4 element from bacterial RNase P RNA.
RNA, 6, 2000
1F7I
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BU of 1f7i by Molmil
SOLUTION STRUCTURE OF THE RNASE P RNA (M1 RNA) P4 STEM C70U MUTANT OLIGORIBONUCLEOTIDE COMPLEXED WITH COBALT (III) HEXAMINE ,NMR, ENSEMBLE OF 12 STRUCTURES
Descriptor: COBALT HEXAMMINE(III), RNASE P RNA RIBOZYME, P4 DOMAIN
Authors:Schmitz, M, Tinoco Jr, I.
Deposit date:2000-06-27
Release date:2000-10-09
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and metal-ion binding of the P4 element from bacterial RNase P RNA.
RNA, 6, 2000
1HP8
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BU of 1hp8 by Molmil
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
6WPV
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BU of 6wpv by Molmil
Solution NMR structure of the orbitide xanthoxycyclin D
Descriptor: Xanthoxycyclin D
Authors:Rosengren, K.J, Payne, C.D.
Deposit date:2020-04-28
Release date:2020-08-26
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:The genetic origin of evolidine, the first cyclopeptide discovered in plants, and related orbitides.
J.Biol.Chem., 295, 2020

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数据于2024-07-10公开中

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