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5EKJ
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BU of 5ekj by Molmil
Human Carbonic Anhydrase II complexed with a two-faced guest
Descriptor: 2-(butylamino)-~{N}-[2-(4-sulfamoylphenyl)ethyl]ethanamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Roose, B.W, Dmochowski, I.J.
Deposit date:2015-11-03
Release date:2016-01-06
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.129 Å)
Cite:Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5EKH
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BU of 5ekh by Molmil
Human Carbonic Anhydrase II complexed with a two-faced guest
Descriptor: 4-(butylaminomethyl)benzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Roose, B.W, Dmochowksi, I.J.
Deposit date:2015-11-03
Release date:2016-01-06
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.34 Å)
Cite:Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5AX2
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BU of 5ax2 by Molmil
Crystal structure of S.cerevisiae Kti11p
Descriptor: CADMIUM ION, Diphthamide biosynthesis protein 3
Authors:Kumar, A, Nagarathinam, K, Tanabe, M, Balbach, J.
Deposit date:2015-07-13
Release date:2016-07-20
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Hyperbolic Pressure-Temperature Phase Diagram of the Zinc-Finger Protein apoKti11 Detected by NMR Spectroscopy.
J Phys Chem B, 123, 2019
5EKM
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BU of 5ekm by Molmil
Human Carbonic Anhydrase II complexed with a two-faced guest
Descriptor: 2-(butylamino)-~{N}-(4-sulfamoylphenyl)ethanamide, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Roose, B.W, Dmochowski, I.J.
Deposit date:2015-11-03
Release date:2016-01-06
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.33 Å)
Cite:Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5FRG
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BU of 5frg by Molmil
The NMR Structure of the Cdc42-interacting region of TOCA1
Descriptor: FORMIN-BINDING PROTEIN 1-LIKE
Authors:Watson, J.R, Nietlispach, D, Owen, D, Mott, H.R.
Deposit date:2015-12-17
Release date:2016-05-04
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:Investigation of the Interaction between Cdc42 and its Effector Toca1: Handover of Cdc42 to the Actin Regulator N-Wasp is Facilitated by Differential Binding Affinities.
J.Biol.Chem., 291, 2016
6ZYB
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BU of 6zyb by Molmil
Sarcin-Ricin Loop RNA from Ecoli with a C2667-2'-OCF3 modification
Descriptor: Sarcin-Ricin Loop RNA from Ecoli with a C2667-2'-OCF3 modification
Authors:Ennifar, E.
Deposit date:2020-07-31
Release date:2020-12-16
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (0.9 Å)
Cite:2'- O -Trifluoromethylated RNA - a powerful modification for RNA chemistry and NMR spectroscopy.
Chem Sci, 11, 2020
6ZXZ
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BU of 6zxz by Molmil
Sarcin-Ricin Loop RNA from Ecoli with a A2670-2'-OCF3 modification
Descriptor: POTASSIUM ION, SODIUM ION, Sarcin-Ricin Loop RNA from Ecoli with a A2670-2'-OCF3 modification
Authors:Ennifar, E.
Deposit date:2020-07-30
Release date:2020-12-16
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:2'- O -Trifluoromethylated RNA - a powerful modification for RNA chemistry and NMR spectroscopy.
Chem Sci, 11, 2020
1VOP
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BU of 1vop by Molmil
CONSERVED RNA COMPONENT OF THE PEPTIDYL TRANSFERASE CENTER, NMR, 33 STRUCTURES
Descriptor: 23S RIBOSOMAL RNA
Authors:Puglisi, E.V, Puglisi, J.D.
Deposit date:1997-08-30
Release date:1997-12-24
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Structure of a conserved RNA component of the peptidyl transferase centre.
Nat.Struct.Biol., 4, 1997
1MP6
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BU of 1mp6 by Molmil
Structure of the transmembrane region of the M2 protein H+ channel by solid state NMR spectroscopy
Descriptor: Matrix protein M2
Authors:Wang, J, Kim, S, Kovacs, F, Cross, T.A.
Deposit date:2002-09-11
Release date:2002-09-25
Last modified:2024-05-22
Method:SOLID-STATE NMR
Cite:Structure of the transmembrane region of the M2 protein H(+) channel.
Protein Sci., 10, 2001
4Q49
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BU of 4q49 by Molmil
Room temperature neutron crystal structure of apo human carbonic anhydrase at pH 7.5
Descriptor: Carbonic anhydrase 2, ZINC ION
Authors:Fisher, S.Z, McKenna, R.
Deposit date:2014-04-14
Release date:2015-02-25
Last modified:2023-09-20
Method:NEUTRON DIFFRACTION (1.8 Å)
Cite:Joint neutron crystallographic and NMR solution studies of Tyr residue ionization and hydrogen bonding: Implications for enzyme-mediated proton transfer.
Proc.Natl.Acad.Sci.USA, 112, 2015
4QZS
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BU of 4qzs by Molmil
Crystal structure of the first bromodomain of human 3-fluoro tyrosine-labeled brd4 in complex with jq1
Descriptor: (6S)-6-(2-tert-butoxy-2-oxoethyl)-4-(4-chlorophenyl)-2,3,9-trimethyl-6,7-dihydrothieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-10-ium, 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ...
Authors:Ember, S.W, Schonbrunn, E.
Deposit date:2014-07-28
Release date:2014-10-29
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Fluorinated aromatic amino acids are sensitive (19)f NMR probes for bromodomain-ligand interactions.
Acs Chem.Biol., 9, 2014
5ID3
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BU of 5id3 by Molmil
Solution structure of the pore-forming region of C. elegans Mitochondrial Calcium Uniporter (MCU)
Descriptor: Mitochondrial Calcium Uniporter
Authors:Oxenoid, K, Dong, Y, Cao, C, Cui, T, Sancak, Y, Markhard, A.L, Grabarek, Z, Kong, L, Liu, Z, Ouyang, B, Cong, Y, Mootha, V.K, Chou, J.J, Membrane Protein Structures by Solution NMR (MPSbyNMR)
Deposit date:2016-02-23
Release date:2016-05-04
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Architecture of the mitochondrial calcium uniporter.
Nature, 533, 2016
1MB6
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BU of 1mb6 by Molmil
Three dimensional solution structure of huwentoxin-IV by 2D 1H-NMR
Descriptor: huwentoxin-iv
Authors:Peng, K, Shu, Q, Liang, S.P.
Deposit date:2002-08-02
Release date:2002-08-21
Last modified:2017-11-29
Method:SOLUTION NMR
Cite:Function and solution structure of huwentoxin-IV, a potent neuronal tetrodotoxin (TTX)-sensitive sodium channel antagonist from Chinese bird spider Selenocosmia huwena
J.Biol.Chem., 277, 2002
8ONG
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BU of 8ong by Molmil
Structure of the endothelial monocyte activating polypeptide II (EMAP II) in solution
Descriptor: Aminoacyl tRNA synthase complex-interacting multifunctional protein 1
Authors:Lozhko, D, Kolomiiets, L, Kornelyuk, A.I, Zhukov, I.
Deposit date:2023-04-02
Release date:2024-04-10
Method:SOLUTION NMR, SOLUTION SCATTERING
Cite:Structural analysis and conformational flexibility of endothelial monocyte activating polypeptide II (EMAP II) by means NMR spectroscopy and molecular dynamics simulations
To Be Published
4YU9
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BU of 4yu9 by Molmil
Crystal Structure of double mutant Y115E Y117E human Glutaminyl Cyclase
Descriptor: 1,2-ETHANEDIOL, Glutaminyl-peptide cyclotransferase, SULFATE ION, ...
Authors:Di Pisa, F, Pozzi, C, Benvenuti, M, Mangani, S.
Deposit date:2015-03-18
Release date:2015-08-05
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The soluble Y115E-Y117E variant of human glutaminyl cyclase is a valid target for X-ray and NMR screening of inhibitors against Alzheimer disease.
Acta Crystallogr.,Sect.F, 71, 2015
4YWY
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BU of 4ywy by Molmil
Crystal Structure of double mutant Y115E Y117E human Glutaminyl Cyclase in complex with inhibitor PBD-150
Descriptor: 1,2-ETHANEDIOL, 1-(3,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)propyl]thiourea, CHLORIDE ION, ...
Authors:Di Pisa, F, Pozzi, C, Benvenuti, M, Mangani, S.
Deposit date:2015-03-21
Release date:2015-08-05
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The soluble Y115E-Y117E variant of human glutaminyl cyclase is a valid target for X-ray and NMR screening of inhibitors against Alzheimer disease.
Acta Crystallogr.,Sect.F, 71, 2015
5LS3
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BU of 5ls3 by Molmil
Crystal structure of metallo-beta-lactamase SPM-1 with Y58C mutation
Descriptor: Beta-lactamase IMP-1, ZINC ION
Authors:Hinchliffe, P, Spencer, J.
Deposit date:2016-08-22
Release date:2017-03-15
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.754 Å)
Cite:(19) F-NMR Reveals the Role of Mobile Loops in Product and Inhibitor Binding by the Sao Paulo Metallo-beta-Lactamase.
Angew. Chem. Int. Ed. Engl., 56, 2017
7MPA
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BU of 7mpa by Molmil
Structure and topology of DWORF in bicelles by oriented solid-state NMR
Descriptor: Sarcoplasmic/endoplasmic reticulum calcium ATPase regulator DWORF
Authors:Reddy, U.V, Weber, D.K, Veglia, G.V.
Deposit date:2021-05-04
Release date:2021-06-30
Last modified:2024-05-15
Method:SOLID-STATE NMR
Cite:A kink in DWORF helical structure controls the activation of the sarcoplasmic reticulum Ca 2+ -ATPase.
Structure, 30, 2022
7CKG
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BU of 7ckg by Molmil
Crystal structure of TMSiPheRS complexed with TMSiPhe
Descriptor: 4-(trimethylsilyl)-L-phenylalanine, Tyrosine--tRNA ligase
Authors:Sun, J.P, Wang, J.Y, Zhu, Z.L, He, Q.T, Xiao, P.
Deposit date:2020-07-17
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.053 Å)
Cite:DeSiphering receptor core-induced and ligand-dependent conformational changes in arrestin via genetic encoded trimethylsilyl 1 H-NMR probe.
Nat Commun, 11, 2020
7CKH
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BU of 7ckh by Molmil
Crystal structure of TMSiPheRS
Descriptor: Tyrosine--tRNA ligase
Authors:Sun, J.P, Wang, J.Y, Zhu, Z.L, He, Q.T, Xiao, P.
Deposit date:2020-07-17
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.79492676 Å)
Cite:DeSiphering receptor core-induced and ligand-dependent conformational changes in arrestin via genetic encoded trimethylsilyl 1 H-NMR probe.
Nat Commun, 11, 2020
7BV9
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BU of 7bv9 by Molmil
The NMR structure of the BEN domain from human NAC1
Descriptor: Nucleus accumbens-associated protein 1
Authors:Nagata, T, Kobayashi, N, Nakayama, N, Obayashi, E, Urano, T.
Deposit date:2020-04-09
Release date:2021-02-17
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Nucleus Accumbens-Associated Protein 1 Binds DNA Directly through the BEN Domain in a Sequence-Specific Manner.
Biomedicines, 8, 2020
7K3S
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BU of 7k3s by Molmil
Solution NMR Structure of the Coiled-coil BRCA1-PALB2 Heterodimer
Descriptor: Breast cancer type 1 susceptibility protein homolog, Partner and localizer of BRCA2
Authors:Daigham, N.S, Liu, G, Bunting, S.F, Montelione, G.T.
Deposit date:2020-09-13
Release date:2021-09-29
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:The Structural Basis for Interactions Between PALB2 and BRCA1 that Mediate the Homologous Recombination DNA Damage Repair Process
To Be Published
7JYN
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BU of 7jyn by Molmil
Solution NMR structure of human Brd3 ET complexed with NSD3(148-184) peptide
Descriptor: Bromodomain-containing protein 3, Histone-lysine N-methyltransferase NSD3
Authors:Aiyer, S, Swapna, G.V.T, Roth, M.J, Montelione, G.T.
Deposit date:2020-08-31
Release date:2021-06-23
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:A common binding motif in the ET domain of BRD3 forms polymorphic structural interfaces with host and viral proteins.
Structure, 29, 2021
4GKA
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BU of 4gka by Molmil
Crystal structure of purine nucleoside phosphorylase (W16Y, W94Y, W178Y, H257W) mutant from human complexed with phosphate
Descriptor: GLYCEROL, PHOSPHATE ION, Purine nucleoside phosphorylase
Authors:Haapalainen, A.M, Ho, M.C, Suarez, J.J, Almo, S.C, Schramm, V.L.
Deposit date:2012-08-10
Release date:2013-02-06
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Catalytic Site Conformations in Human PNP by (19)F-NMR and Crystallography.
Chem.Biol., 20, 2013
7EH3
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BU of 7eh3 by Molmil
Structure of Nanobody Nb23 in solution using NMR spectroscopy
Descriptor: Nb23
Authors:Percipalle, M, Hunashal, Y, Esposito, G, Fogolari, F.
Deposit date:2021-03-28
Release date:2021-07-14
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Structure of Nanobody Nb23.
Molecules, 26, 2021

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数据于2024-07-10公开中

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