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7OBF
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BU of 7obf by Molmil
Crystal structure of the human VH antibody domain HEL4
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, GLYCEROL, HEL4, ...
Authors:Belviso, B.D, Caliandro, R, Carrozzini, B.
Deposit date:2021-04-22
Release date:2021-05-05
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.699 Å)
Cite:Crystal structure of the human VH antibody domain HEL4
To Be Published
4QOT
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BU of 4qot by Molmil
Crystal structure of human copper chaperone bound to the platinum ion
Descriptor: Copper transport protein ATOX1, PLATINUM (II) ION, SULFATE ION
Authors:Belviso, B.D, Galliani, A, Caliandro, R, Arnesano, F, Natile, G.
Deposit date:2014-06-20
Release date:2015-06-24
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Oxaliplatin Binding to Human Copper Chaperone Atox1 and Protein Dimerization
Inorg.Chem., 55, 2016
4DPE
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BU of 4dpe by Molmil
Structure of MMP3 complexed with a platinum-based inhibitor.
Descriptor: CALCIUM ION, CHLORIDE ION, N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID, ...
Authors:Belviso, B.D, Arnesano, F, Calderone, V, Caliandro, R, Natile, G, Siliqi, D.
Deposit date:2012-02-13
Release date:2013-02-20
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Structure of matrix metalloproteinase-3 with a platinum-based inhibitor.
Chem.Commun.(Camb.), 49, 2013
7B9J
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BU of 7b9j by Molmil
Lysozyme crystallized in the presence of the hydrated deep eutectic solvent Choline chloride-Urea 1:2
Descriptor: ACETATE ION, CHLORIDE ION, CHOLINE ION, ...
Authors:Belviso, B.D, Caliandro, R, Carrozzini, B.
Deposit date:2020-12-14
Release date:2021-10-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Introducing Protein Crystallization in Hydrated Deep Eutectic Solvents
Acs Sustain Chem Eng, 9, 2021
7BB1
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BU of 7bb1 by Molmil
Lysozyme crystallized in the presence of the hydrated deep eutectic solvent Choline chloride-Glutamic acid 2:1
Descriptor: ACETATE ION, CHLORIDE ION, CHOLINE ION, ...
Authors:Belviso, B.D, Caliandro, R, Carrozzini, B.
Deposit date:2020-12-16
Release date:2021-10-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Introducing Protein Crystallization in Hydrated Deep Eutectic Solvents
Acs Sustain Chem Eng, 9, 2021
7BAZ
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BU of 7baz by Molmil
Lysozyme crystallized in the presence of the hydrated deep eutectic solvent Choline chloride-Glycerol 1:2
Descriptor: ACETATE ION, CHLORIDE ION, CHOLINE ION, ...
Authors:Belviso, B.D, Caliandro, R, Carrozzini, B.
Deposit date:2020-12-16
Release date:2021-10-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Introducing Protein Crystallization in Hydrated Deep Eutectic Solvents
Acs Sustain Chem Eng, 9, 2021
6QUK
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BU of 6quk by Molmil
Protein crystallization by ionic liquid hydrogel support: glucose isomerase grown by using ionic liquid hydrogel
Descriptor: GLYCEROL, MANGANESE (II) ION, SULFATE ION, ...
Authors:Belviso, B.D, Caliandro, R, Caliandro, R.
Deposit date:2019-02-27
Release date:2019-03-13
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Protein Crystallization in Ionic-Liquid Hydrogel Composite Membranes
Crystals, 9, 2019
6QUF
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BU of 6quf by Molmil
Protein crystallization by ionic liquid hydrogel support: reference crystal of glucose isomerase grown on standard silanized glass
Descriptor: GLYCEROL, MANGANESE (II) ION, SULFATE ION, ...
Authors:Belviso, B.D, Caliandro, R, Caliandro, R.
Deposit date:2019-02-27
Release date:2019-03-13
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.19 Å)
Cite:Protein Crystallization in Ionic-Liquid Hydrogel Composite Membranes
Crystals, 9, 2019
6EO8
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BU of 6eo8 by Molmil
Crystal structure of thrombin in complex with a novel glucose-conjugated potent inhibitor
Descriptor: DIMETHYL SULFOXIDE, Hirudin variant-2, N-(2-{[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methoxy}-6-[3-(beta-D-glucopyranosyloxy)propoxy]phenyl)-1-(propan-2-yl)piperidine-4-carboxamide, ...
Authors:Belviso, B.D, Caliandro, R, Aresta, B.M, De Candia, M, Altomare, C.D.
Deposit date:2017-10-09
Release date:2017-12-13
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:How a beta-D-glucoside side chain enhances binding affinity to thrombin of inhibitors bearing 2-chlorothiophene as P1 moiety: crystallography, fragment deconstruction study, and evaluation of antithrombotic properties.
J. Med. Chem., 57, 2014
6EO9
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BU of 6eo9 by Molmil
Crystal structure of thrombin in complex with a novel glucose-conjugated potent inhibitor
Descriptor: DIMETHYL SULFOXIDE, Hirudin variant-2, N-(2-{[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methoxy}-6-{3-[(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy]propoxy}phenyl)-1-(propan-2-yl)piperidine-4-carboxamide, ...
Authors:Belviso, B.D, Caliandro, R, Aresta, B.M, De Candia, M, Altomare, C.D.
Deposit date:2017-10-09
Release date:2017-12-13
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:How a beta-D-glucoside side chain enhances binding affinity to thrombin of inhibitors bearing 2-chlorothiophene as P1 moiety: crystallography, fragment deconstruction study, and evaluation of antithrombotic properties.
J. Med. Chem., 57, 2014
4G9L
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BU of 4g9l by Molmil
Structure of MMP3 complexed with NNGH inhibitor.
Descriptor: CALCIUM ION, N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID, Stromelysin-1, ...
Authors:Belviso, B.D, Arnesano, F, Calderone, V, Caliandro, R, Natile, G, Siliqi, D.
Deposit date:2012-07-24
Release date:2013-05-29
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Structure of matrix metalloproteinase-3 with a platinum-based inhibitor.
Chem.Commun.(Camb.), 49, 2013
4JA1
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BU of 4ja1 by Molmil
Structure of MMP3 complexed with a platinum-based inhibitor
Descriptor: CALCIUM ION, CHLORIDE ION, N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID, ...
Authors:Belviso, B.D, Arnesano, F, Calderone, V, Caliandro, R, Natile, G, Siliqi, D.
Deposit date:2013-02-18
Release date:2013-02-27
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Structure of matrix metalloproteinase-3 with a platinum-based inhibitor.
Chem.Commun.(Camb.), 49, 2013
6TOV
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BU of 6tov by Molmil
Crystal Structure of Teicoplanin Aglycone
Descriptor: DIMETHYL SULFOXIDE, Teicoplanin Aglycone
Authors:Belviso, B.D, Carrozzini, B, Caliandro, R, Altomare, C.D, Bolognino, I, Cellamare, S.
Deposit date:2019-12-12
Release date:2020-01-15
Last modified:2022-01-19
Method:X-RAY DIFFRACTION (0.767 Å)
Cite:Enantiomeric Separation and Molecular Modelling of Bioactive 4-Aryl-3,4-dihydropyrimidin-2(1H)-one Ester Derivatives on Teicoplanin-Based Chiral Stationary Phase
Separations, 2022
6FHO
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BU of 6fho by Molmil
Crystal structure of pqsL, a probable FAD-dependent monooxygenase from Pseudomonas aeruginosa - new refinement
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Probable FAD-dependent monooxygenase
Authors:Belviso, B.D, Drees, S.L, Ernst, S, Jagmann, N, Hennecke, U, Fetzner, S.
Deposit date:2018-01-15
Release date:2018-04-25
Last modified:2018-06-27
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:PqsL uses reduced flavin to produce 2-hydroxylaminobenzoylacetate, a preferred PqsBC substrate in alkyl quinolone biosynthesis inPseudomonas aeruginosa.
J. Biol. Chem., 293, 2018
7ZC3
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BU of 7zc3 by Molmil
Crystal structure of human copper chaperone Atox1 bound to zinc ion by CxxC motif
Descriptor: Copper transport protein ATOX1, SULFATE ION, ZINC ION
Authors:Mangini, V, Belviso, B.D, Arnesano, F, Caliandro, R.
Deposit date:2022-03-25
Release date:2022-04-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structure of the Human Copper Chaperone ATOX1 Bound to Zinc Ion.
Biomolecules, 12, 2022
6Y3C
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BU of 6y3c by Molmil
Human COX-1 Crystal Structure
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CITRATE ANION, Prostaglandin G/H synthase 1, ...
Authors:Miciaccia, M, Belviso, B.D, Iaselli, M, Ferorelli, S, Perrone, M.G, Caliandro, R, Scilimati, A.
Deposit date:2020-02-18
Release date:2020-02-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.361 Å)
Cite:Three-dimensional structure of human cyclooxygenase (hCOX)-1.
Sci Rep, 11, 2021
6TT0
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BU of 6tt0 by Molmil
Crystal structure of a potent and reversible dual binding site Acetylcholinesterase chiral inhibitor
Descriptor: (1~{R},3~{S})-~{N}-(6,7-dimethoxy-2-oxidanylidene-chromen-3-yl)-3-[(phenylmethyl)amino]cyclohexane-1-carboxamide, 2-acetamido-2-deoxy-beta-D-glucopyranose, Acetylcholinesterase
Authors:de la Mora, E, Mangiatordi, G.F, Belviso, B.D, Caliandro, R, Colletier, J.P, Catto, M.
Deposit date:2019-12-22
Release date:2020-06-10
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.80003023 Å)
Cite:Chiral Separation, X-ray Structure, and Biological Evaluation of a Potent and Reversible Dual Binding Site AChE Inhibitor.
Acs Med.Chem.Lett., 11, 2020
6QF7
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BU of 6qf7 by Molmil
Crystal structures of the recombinant beta-Factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XII, ...
Authors:Pathak, M, Mannal, R, Li, C, Bubacarr, G.K, Badraldin, K.H, Belviso, B.D, Camila, R.B, Dreveny, I, Fischer, P.M, Dekker, L.V, Oliva, M.L.V, Emsley, J.
Deposit date:2019-01-09
Release date:2019-06-05
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (4 Å)
Cite:Crystal structures of the recombinant beta-factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics.
Acta Crystallogr D Struct Biol, 75, 2019
3N30
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BU of 3n30 by Molmil
Crystal Structure of cubic Zn3-hUb (human ubiquitin) adduct
Descriptor: Ubiquitin, ZINC ION
Authors:Siliqi, D, Caliandro, R, Arnesano, F, Natile, G, Falini, G, Fermani, S, Belviso, B.D.
Deposit date:2010-05-19
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystallographic analysis of metal-ion binding to human ubiquitin.
Chemistry, 17, 2011
3N32
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BU of 3n32 by Molmil
The crystal structure of human Ubiquitin adduct with Zeise's salt
Descriptor: PLATINUM (II) ION, Ubiquitin
Authors:Siliqi, D, Caliandro, R, Falini, G, Fermani, S, Natile, G, Arnesano, F, Belviso, B.D.
Deposit date:2010-05-19
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.795 Å)
Cite:Crystallographic analysis of metal-ion binding to human ubiquitin.
Chemistry, 17, 2011
6GT6
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BU of 6gt6 by Molmil
Crystal structure of recombinant coagulation factor beta-XIIa
Descriptor: CYSTEINE, Coagulation factor XII, GLYCEROL, ...
Authors:Pathak, M, Emsley, J.
Deposit date:2018-06-15
Release date:2019-07-17
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.54 Å)
Cite:Crystal structures of the recombinant beta-factor XIIa protease with bound Thr-Arg and Pro-Arg substrate mimetics.
Acta Crystallogr D Struct Biol, 75, 2019
8OR9
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BU of 8or9 by Molmil
Human holo aromatic L-amino acid decarboxylase (AADC) native structure at physiological pH
Descriptor: Dopa decarboxylase (Aromatic L-amino acid decarboxylase), PYRIDOXAL-5'-PHOSPHATE, TETRAETHYLENE GLYCOL
Authors:Bisello, G, Perduca, M, Bertoldi, M.
Deposit date:2023-04-13
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Human aromatic amino acid decarboxylase is an asymmetric and flexible enzyme: Implication in aromatic amino acid decarboxylase deficiency.
Protein Sci., 32, 2023
8ORA
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BU of 8ora by Molmil
Human holo aromatic L-amino acid decarboxylase (AADC) external aldimine with L-Dopa methylester
Descriptor: Dopa decarboxylase (Aromatic L-amino acid decarboxylase), PYRIDOXAL-5'-PHOSPHATE, TETRAETHYLENE GLYCOL, ...
Authors:Bisello, G, Perduca, M, Bertoldi, M.
Deposit date:2023-04-13
Release date:2023-08-30
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Human aromatic amino acid decarboxylase is an asymmetric and flexible enzyme: Implication in aromatic amino acid decarboxylase deficiency.
Protein Sci., 32, 2023
4K7S
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BU of 4k7s by Molmil
Crystal structure of Zn2-hUb (human ubiquitin) adduct from a solution 35 mM zinc acetate/1.3 mM hUb
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, ZINC ION, ...
Authors:Fermani, S, Falini, G, Calvaresi, M, Bottoni, A, Arnesano, F, Natile, G.
Deposit date:2013-04-17
Release date:2013-05-08
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Conformational selection of ubiquitin quaternary structures driven by zinc ions.
Chemistry, 19, 2013
4K7U
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BU of 4k7u by Molmil
Crystal structure of Zn2.3-hUb (human ubiquitin) adduct from a solution 70 mM zinc acetate/1.3 mM hUb
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Fermani, S, Falini, G, Calvaresi, M, Bottoni, A, Arnesano, F, Natile, G.
Deposit date:2013-04-17
Release date:2013-05-08
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Conformational selection of ubiquitin quaternary structures driven by zinc ions.
Chemistry, 19, 2013

 

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