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8HO2
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BU of 8ho2 by Molmil
crystal structure of Norcoclaurine synthase from Chinese lotus (Nelumbo nucicera)
Descriptor: S-norcoclaurine synthase
Authors:Liao, L.J, Zhao, Y.C.
Deposit date:2022-12-09
Release date:2023-12-06
Method:X-RAY DIFFRACTION (1.711 Å)
Cite:The crystal structure of Norcoclaurine synthase from Chinese lotus (Nelumbo nucicera) was investigated to determine its catalytic mechanism and enantioselectivity.
To Be Published
1H2Z
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BU of 1h2z by Molmil
PROLYL OLIGOPEPTIDASE FROM PORCINE BRAIN, S554A MUTANT WITH BOUND PEPTIDE LIGAND SUC-GLY-PRO
Descriptor: GLYCEROL, GLYCINE, PROLINE, ...
Authors:Rea, D, Fulop, V.
Deposit date:2002-08-20
Release date:2002-11-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Electrostatic Effects and Binding Determinants in the Catalysis of Prolyl Oligopeptidase: Site Specific Mutagenesis at the Oxyanion Binding Site
J.Biol.Chem., 277, 2002
5OL1
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BU of 5ol1 by Molmil
Crystal structure of an inactivated Ssp SICLOPPS intein with a CAFHPQ extein
Descriptor: 1,2-ETHANEDIOL, BETA-MERCAPTOETHANOL, DNA polymerase III subunit alpha,DNA polymerase III subunit alpha, ...
Authors:Kick, L.M, Schneider, S.
Deposit date:2017-07-26
Release date:2017-09-27
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.751 Å)
Cite:Mechanistic Insights into Cyclic Peptide Generation by DnaE Split-Inteins through Quantitative and Structural Investigation.
Chembiochem, 18, 2017
5OC2
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BU of 5oc2 by Molmil
Crystal structure of Asp295Cys/Lys303Cys Amadoriase I mutant from Aspergillus Fumigatus
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Fructosyl amine:oxygen oxidoreductase
Authors:Rigoldi, F, Donini, S, Gautieri, A, Parisini, E.
Deposit date:2017-06-29
Release date:2018-02-28
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Thermal stabilization of the deglycating enzyme Amadoriase I by rational design.
Sci Rep, 8, 2018
2XBF
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BU of 2xbf by Molmil
Nedd4 HECT structure
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, E3 UBIQUITIN-PROTEIN LIGASE NEDD4
Authors:Maspero, E, Cecatiello, V, Musacchio, A, Polo, S, Pasqualato, S.
Deposit date:2010-04-09
Release date:2011-03-23
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.503 Å)
Cite:Structure of the Hect:Ubiquitin Complex and its Role in Ubiquitin Chain Elongation
Embo Rep., 12, 2011
7ND1
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BU of 7nd1 by Molmil
First-in-class small molecule inhibitors of Polycomb Repressive Complex 1 (PRC1) RING domain
Descriptor: 3-(2-chlorophenyl)-4-ethyl-5-(1~{H}-indol-4-yl)-1~{H}-pyrrole-2-carboxylic acid, E3 ubiquitin-protein ligase RING2, Polycomb complex protein BMI-1, ...
Authors:Cierpicki, T, Lund, G, Jaremko, L.
Deposit date:2021-01-29
Release date:2021-06-16
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Small-molecule inhibitors targeting Polycomb repressive complex 1 RING domain.
Nat.Chem.Biol., 17, 2021
8ISQ
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BU of 8isq by Molmil
Crystal structure of extended-spectrum class A beta-lactamase, CESS-1 E166Q acylated by ampicillin
Descriptor: (2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Beta-lactamase, ...
Authors:Jeong, B.G, Kim, M.Y, Jeong, C.S, Do, H.W, Lee, J.H, Cha, S.S.
Deposit date:2023-03-21
Release date:2024-05-15
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Characterization of the extended substrate spectrum of the class A beta-lactamase CESS-1 from Stenotrophomonas sp. and structure-based investigation into its substrate preference.
Int J Antimicrob Agents, 63, 2024
8ISP
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BU of 8isp by Molmil
Crystal structure of extended-spectrum class A beta-lactamase, CESS-1 E166Q acylated by cephalexin
Descriptor: (R)-2-((R)-((R)-2-amino-2-phenylacetamido)(carboxy)methyl)-5-methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Beta-lactamase
Authors:Jeong, B.G, Kim, M.Y, Jeong, C.S, Do, H.W, Lee, J.H, Cha, S.S.
Deposit date:2023-03-21
Release date:2024-05-15
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Characterization of the extended substrate spectrum of the class A beta-lactamase CESS-1 from Stenotrophomonas sp. and structure-based investigation into its substrate preference.
Int J Antimicrob Agents, 63, 2024
8ISO
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BU of 8iso by Molmil
Crystal structure of extended-spectrum class A beta-lactamase, CESS-1
Descriptor: 1,2-ETHANEDIOL, 1-METHOXY-2-[2-(2-METHOXY-ETHOXY]-ETHANE, Beta-lactamase
Authors:Jeong, B.G, Kim, M.Y, Jeong, C.S, Do, H.W, Lee, J.H, Cha, S.S.
Deposit date:2023-03-21
Release date:2024-05-15
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:Characterization of the extended substrate spectrum of the class A beta-lactamase CESS-1 from Stenotrophomonas sp. and structure-based investigation into its substrate preference.
Int J Antimicrob Agents, 63, 2024
8ISR
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BU of 8isr by Molmil
Crystal structure of extended-spectrum class A beta-lactamase, CESS-1 E166Q acylated by cefaclor
Descriptor: (R)-2-((R)-((R)-2-amino-2-phenylacetamido)(carboxy)methyl)-5-chloro-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, 1,2-ETHANEDIOL, Beta-lactamase
Authors:Jeong, B.G, Kim, M.Y, Jeong, C.S, Do, H.W, Lee, J.H, Cha, S.S.
Deposit date:2023-03-21
Release date:2024-05-15
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Characterization of the extended substrate spectrum of the class A beta-lactamase CESS-1 from Stenotrophomonas sp. and structure-based investigation into its substrate preference.
Int J Antimicrob Agents, 63, 2024
6XP9
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BU of 6xp9 by Molmil
STRUCTURE OF HUMAN PREGNANE X RECEPTOR LIGAND BINDING DOMAIN BOUND TETHERED WITH SRC co-activator peptide IN COMPLEX WITH (S,S)-1
Descriptor: (2S)-tert-butoxy[7-(8-fluoro-5-methyl-3,4-dihydro-2H-1-benzopyran-6-yl)-5-methyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl]acetic acid, GLYCEROL, Nuclear receptor subfamily 1 group I member 2,Nuclear receptor coactivator 1 fusion
Authors:Khan, J.A.
Deposit date:2020-07-08
Release date:2020-09-23
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Structure-based amelioration of PXR transactivation in a novel series of macrocyclic allosteric inhibitors of HIV-1 integrase.
Bioorg.Med.Chem.Lett., 30, 2020
5OL7
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BU of 5ol7 by Molmil
Crystal structure of an inactivated Npu SICLOPPS intein with CFAHPQ extein
Descriptor: CALCIUM ION, COBALT (II) ION, DNA-directed DNA polymerase,DNA-directed DNA polymerase
Authors:Kick, L.M, Schneider, S.
Deposit date:2017-07-26
Release date:2017-09-27
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Mechanistic Insights into Cyclic Peptide Generation by DnaE Split-Inteins through Quantitative and Structural Investigation.
Chembiochem, 18, 2017
8THO
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BU of 8tho by Molmil
Solution structure of the zinc finger repeat domain of BCL11A (ZnF456)
Descriptor: B-cell lymphoma/leukemia 11A, ZINC ION
Authors:Viennet, T, Yin, M, Orkin, S.H, Arthanari, H.
Deposit date:2023-07-17
Release date:2024-07-24
Method:SOLUTION NMR
Cite:Structural and dynamic investigation of DNA-binding by BCL11A reveals a specific role for ZnF6
To Be Published
8IJM
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BU of 8ijm by Molmil
Cyo-EM structure of K794A non-gastric proton pump in Na+ bound E1AMPPCP state
Descriptor: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL, ...
Authors:Abe, K.
Deposit date:2023-02-27
Release date:2023-08-02
Last modified:2023-08-09
Method:ELECTRON MICROSCOPY (3.13 Å)
Cite:An unusual conformation from Na + -sensitive non-gastric proton pump mutants reveals molecular mechanisms of cooperative Na + -binding.
Biochim Biophys Acta Mol Cell Res, 1870, 2023
3UG3
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BU of 3ug3 by Molmil
Crystal structure of alpha-L-arabinofuranosidase from Thermotoga maritima ligand free form
Descriptor: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Alpha-L-arabinofuranosidase, ...
Authors:Im, D.-H, Miyazaki, K, Wakagi, T, Fushinobu, S.
Deposit date:2011-11-02
Release date:2012-03-07
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structures of Glycoside Hydrolase Family 51 alpha-L-Arabinofuranosidase from Thermotoga maritima
Biosci.Biotechnol.Biochem., 76, 2012
8IJL
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BU of 8ijl by Molmil
Cyo-EM structure of wildtype non-gastric proton pump in the presence of Na+, AlF and ADP
Descriptor: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-{[(4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranosyl)oxy]methyl}-4-{[(3beta,9beta,14beta,17beta,25R)-spirost-5-en-3-yl]oxy}butyl 4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranoside, ...
Authors:Abe, K.
Deposit date:2023-02-27
Release date:2023-10-18
Method:ELECTRON MICROSCOPY (2.62 Å)
Cite:An unusual conformation from Na + -sensitive non-gastric proton pump mutants reveals molecular mechanisms of cooperative Na + -binding.
Biochim Biophys Acta Mol Cell Res, 1870, 2023
7QEK
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BU of 7qek by Molmil
Structure of the ligand binding domain of the antibiotic biosynthesis regulator AdmX from the rhizobacterium Serratia plymuthica A153 bound to the auxin indole-3-piruvic acid (IPA).
Descriptor: 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID, MAGNESIUM ION, regulator AdmX
Authors:Gavira, J.A, Rico-Jimenez, M, Castellvi, A, Krell, T, Matilla, M.A.
Deposit date:2021-12-03
Release date:2022-12-14
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Emergence of an Auxin Sensing Domain in Plant-Associated Bacteria.
Mbio, 14, 2023
8I6U
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BU of 8i6u by Molmil
The cryo-EM structure of OsCyc1 dimer state
Descriptor: Syn-copalyl diphosphate synthase, chloroplastic
Authors:Ma, X.L, Xu, H.F, Tong, Y.R, Luo, Y.F, Dong, Q.H, Jiang, T.
Deposit date:2023-01-29
Release date:2023-12-06
Method:ELECTRON MICROSCOPY (7.9 Å)
Cite:Structural and functional investigations of syn-copalyl diphosphate synthase from Oryza sativa.
Commun Chem, 6, 2023
7BEA
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BU of 7bea by Molmil
Structure of human Programmed cell death 1 ligand 1 (PD-L1) with inhibitor
Descriptor: 2-(aminomethyl)-6-[(2-methyl-3-phenyl-phenyl)methoxy]-~{N}-(2-phenylethyl)imidazo[1,2-a]pyridin-3-amine, Programmed cell death 1 ligand 1
Authors:Magiera-Mularz, K, Butera, R, Wazynska, M, Holak, T, Domling, A.
Deposit date:2020-12-22
Release date:2021-06-09
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Design, Synthesis, and Biological Evaluation of Imidazopyridines as PD-1/PD-L1 Antagonists.
Acs Med.Chem.Lett., 12, 2021
8I6T
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BU of 8i6t by Molmil
The cryo-EM structure of OsCyc1 hexamer state
Descriptor: Syn-copalyl diphosphate synthase, chloroplastic
Authors:Ma, X.L, Xu, H.F, Tong, Y.R, Luo, Y.F, Dong, Q.H, Jiang, T.
Deposit date:2023-01-29
Release date:2023-12-06
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Structural and functional investigations of syn-copalyl diphosphate synthase from Oryza sativa.
Commun Chem, 6, 2023
8I6P
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BU of 8i6p by Molmil
The cryo-EM structure of OsCyc1 tetramer state
Descriptor: Syn-copalyl diphosphate synthase, chloroplastic
Authors:Ma, X.L, Xu, H.F, Tong, Y.R, Luo, Y.F, Dong, Q.H, Jiang, T.
Deposit date:2023-01-29
Release date:2023-12-06
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structural and functional investigations of syn-copalyl diphosphate synthase from Oryza sativa.
Commun Chem, 6, 2023
8IH5
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BU of 8ih5 by Molmil
The cryo-EM structure of OsCyc1 that complexed with GGPP
Descriptor: GERANYLGERANYL DIPHOSPHATE, Syn-copalyl diphosphate synthase, chloroplastic
Authors:Ma, X.L, Xu, H.F, Jiang, T.
Deposit date:2023-02-22
Release date:2023-12-06
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structural and functional investigations of syn-copalyl diphosphate synthase from Oryza sativa.
Commun Chem, 6, 2023
5FG0
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BU of 5fg0 by Molmil
Structure of the conserved yeast listerin (Ltn1) N-terminal domain, MONOCLINIC FORM
Descriptor: 1,2-ETHANEDIOL, E3 ubiquitin-protein ligase listerin, POTASSIUM ION
Authors:Doamekpor, S.K, Lima, C.D.
Deposit date:2015-12-19
Release date:2016-07-06
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.41 Å)
Cite:Structure and function of the yeast listerin (Ltn1) conserved N-terminal domain in binding to stalled 60S ribosomal subunits.
Proc.Natl.Acad.Sci.USA, 113, 2016
8RAJ
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BU of 8raj by Molmil
NMR structure of PKS docking domains
Descriptor: Beta-ketoacyl synthase, Trimethylamine monooxygenase
Authors:Scat, S, Weissman, K.J, Chagot, B.
Deposit date:2023-12-01
Release date:2024-06-05
Last modified:2024-07-17
Method:SOLUTION NMR
Cite:Insights into docking in megasynthases from the investigation of the toblerol trans -AT polyketide synthase: many alpha-helical means to an end.
Rsc Chem Biol, 5, 2024
5OL6
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BU of 5ol6 by Molmil
Crystal structure of an inactivated Npu SICLOPPS intein with CAFHPQ extein
Descriptor: Nucleic acid binding, OB-fold, tRNA/helicase-type,DNA-directed DNA polymerase
Authors:Kick, L.M, Schneider, S.
Deposit date:2017-07-26
Release date:2017-09-27
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Mechanistic Insights into Cyclic Peptide Generation by DnaE Split-Inteins through Quantitative and Structural Investigation.
Chembiochem, 18, 2017

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數據於2024-07-31公開中

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