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8BE1
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BU of 8be1 by Molmil
SARS-CoV-2 RBD in complex with a Fab fragment of a neutralising antibody mRBD2
Descriptor: Antibody heavy chain, Antibody light chain, SULFATE ION, ...
Authors:Lulla, A, Brear, P, Fischer, K, Hollfelder, F, Hyvonen, M.
Deposit date:2022-10-21
Release date:2023-01-25
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Microfluidics-enabled fluorescence-activated cell sorting of single pathogen-specific antibody secreting cells for the rapid discovery of monoclonal antibodies
Biorxiv, 2023
6HQU
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BU of 6hqu by Molmil
Humanised RadA mutant HumRadA22 in complex with a recombined BRC repeat 8-2
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Breast cancer type 2 susceptibility, DNA repair and recombination protein RadA, ...
Authors:Pantelejevs, T, Lindenburg, L, Hyvonen, M, Hollfelder, F.
Deposit date:2018-09-25
Release date:2019-10-09
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Improved RAD51 binders through motif shuffling based on the modularity of BRC repeats.
Proc.Natl.Acad.Sci.USA, 118, 2021
6FNY
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BU of 6fny by Molmil
CRYSTAL STRUCTURE OF A CHOLINE SULFATASE FROM SINORHIZOBIUM MELLILOTI
Descriptor: CALCIUM ION, Choline-sulfatase
Authors:Valkov, E, Van Loo, B, Hollfelder, F, Hyvonen, M.
Deposit date:2018-02-05
Release date:2018-02-28
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (2.79 Å)
Cite:Structural and Mechanistic Analysis of the Choline Sulfatase from Sinorhizobium melliloti: A Class I Sulfatase Specific for an Alkyl Sulfate Ester.
J. Mol. Biol., 430, 2018
4UPH
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BU of 4uph by Molmil
Crystal Structure of Phosphonate Monoester Hydrolase of Agrobacterium radiobacter
Descriptor: CHLORIDE ION, MAGNESIUM ION, SULFATASE (SULFURIC ESTER HYDROLASE) PROTEIN
Authors:Fischer, G, Loo, B.v, Hyvonen, M, Hollfelder, F.
Deposit date:2014-06-17
Release date:2015-07-01
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
4UPL
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BU of 4upl by Molmil
Dimeric sulfatase SpAS2 from Silicibacter pomeroyi
Descriptor: SULFATASE FAMILY PROTEIN, ZINC ION
Authors:Jonas, S, van Loo, B, Hollfelder, F, Hyvonen, M.
Deposit date:2014-06-17
Release date:2015-07-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.805 Å)
Cite:Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
4UPI
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BU of 4upi by Molmil
Dimeric sulfatase SpAS1 from Silicibacter pomeroyi
Descriptor: SULFATASE FAMILY PROTEIN, ZINC ION
Authors:Jonas, S, van Loo, B, Hollfelder, F, Hyvonen, M.
Deposit date:2014-06-17
Release date:2015-07-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
4UPK
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BU of 4upk by Molmil
Phosphonate monoester hydrolase SpPMH from Silicibacter pomeroyi
Descriptor: PHOSPHONATE MONOESTER HYDROLASE
Authors:Valkov, E, van Loo, B, Hollfelder, F, Hyvonen, M.
Deposit date:2014-06-17
Release date:2015-07-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
2VQR
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BU of 2vqr by Molmil
Crystal structure of a phosphonate monoester hydrolase from rhizobium leguminosarum: a new member of the alkaline phosphatase superfamily
Descriptor: ACETATE ION, CALCIUM ION, MANGANESE (II) ION, ...
Authors:Jonas, S, Hyvonen, M, Hollfelder, F.
Deposit date:2008-03-18
Release date:2008-09-30
Last modified:2019-04-24
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:A New Member of the Alkaline Phosphatase Superfamily with a Formylglycine Nucleophile: Structural and Kinetic Characterisation of a Phosphonate Monoester Hydrolase/Phosphodiesterase from Rhizobium Leguminosarum.
J.Mol.Biol., 384, 2008
6YV5
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BU of 6yv5 by Molmil
Crystal Structure of Serine protease SplB N3Q/S154R from Staphylococcus aureus
Descriptor: SODIUM ION, Serine protease
Authors:Rangel Pereira, M.R, Brear, P, Knyphausen, P, Jermutus, L, Hollfelder, F.
Deposit date:2020-04-27
Release date:2021-05-12
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Crystal Structure of Serine protease SplB N3Q/S154R from Staphylococcus aureus
To Be Published
6YV6
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BU of 6yv6 by Molmil
Crystal Structure of Serine protease SplB N2K/N3Q/S154R from Staphylococcus aureus
Descriptor: DI(HYDROXYETHYL)ETHER, PENTAETHYLENE GLYCOL, Serine protease
Authors:Rangel Pereira, M.R, Brear, P, Knyphausen, P, Jermutus, L, Hollfelder, F.
Deposit date:2020-04-27
Release date:2021-05-12
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.36 Å)
Cite:Crystal Structure of Serine protease SplB N2K/N3Q/S154R from Staphylococcus aureus
to be published
4ZI5
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BU of 4zi5 by Molmil
Crystal Structure of Dienelactone Hydrolase-like Promiscuous Phospotriesterase P91 from Metagenomic Libraries
Descriptor: CHLORIDE ION, MAGNESIUM ION, P91
Authors:Colin, P.-Y, Fischer, G, Hyvonen, M, Hollfelder, F.
Deposit date:2015-04-27
Release date:2016-02-17
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.702 Å)
Cite:Ultrahigh-throughput discovery of promiscuous enzymes by picodroplet functional metagenomics.
Nat Commun, 6, 2015
5AJ9
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BU of 5aj9 by Molmil
G7 mutant of PAS, arylsulfatase from Pseudomonas Aeruginosa
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ARYLSULFATASE, CALCIUM ION, ...
Authors:Miton, C.M, Fischer, G, Jonas, S, Mohammed, M.F, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2015-02-20
Release date:2016-03-16
Last modified:2019-04-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
2W8S
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BU of 2w8s by Molmil
CRYSTAL STRUCTURE OF A catalytically promiscuous PHOSPHONATE MONOESTER HYDROLASE FROM Burkholderia caryophylli
Descriptor: FE (III) ION, GLYCEROL, PHOSPHONATE MONOESTER HYDROLASE, ...
Authors:Jonas, S, van Loo, B, Hyvonen, M, Hollfelder, F.
Deposit date:2009-01-19
Release date:2010-02-23
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:An Efficient, Multiply Promiscuous Hydrolase in the Alkaline Phosphatase Superfamily.
Proc.Natl.Acad.Sci.USA, 107, 2010
4CXK
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BU of 4cxk by Molmil
G9 mutant of PAS, arylsulfatase from Pseudomonas Aeruginosa
Descriptor: ARYLSULFATASE, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Miton, C.M, Jonas, S, Mohammed, M.F, Fischer, G, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2014-04-07
Release date:2015-04-22
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4CXS
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BU of 4cxs by Molmil
G4 mutant of PAS, arylsulfatase from Pseudomonas aeruginosa, in complex with Phenylphosphonic acid
Descriptor: ARYLSULFATASE, CALCIUM ION, SULFATE ION, ...
Authors:Miton, C.M, Jonas, S, Mohammed, M.F, Fischer, G, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2014-04-08
Release date:2015-05-13
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4CYR
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BU of 4cyr by Molmil
G4 mutant of PAS, arylsulfatase from Pseudomonas Aeruginosa
Descriptor: ARYLSULFATASE, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Miton, C.M, Jonas, S, Mohammed, M.F, Fischer, G, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2014-04-14
Release date:2015-04-29
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4CXU
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BU of 4cxu by Molmil
G4 mutant of PAS, arylsulfatase from Pseudomonas Aeruginosa, in complex with 3-Br-Phenolphenylphosphonate
Descriptor: 3-bromophenyl hydrogen (S)-phenylphosphonate, ARYLSULFATASE, CALCIUM ION
Authors:Miton, C.M, Jonas, S, Mohammed, M.F, Fischer, G, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2014-04-08
Release date:2015-04-22
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4CYS
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BU of 4cys by Molmil
G6 mutant of PAS, arylsulfatase from Pseudomonas Aeruginosa, in complex with Phenylphosphonic acid
Descriptor: AMMONIUM ION, ARYLSULFATASE, CALCIUM ION, ...
Authors:Miton, C.M, Jonas, S, Mohammed, M.F, Fischer, G, Loo, B.v, Kintses, B, Hyvonen, M, Tokuriki, N, Hollfelder, F.
Deposit date:2014-04-14
Release date:2015-04-29
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Evolutionary repurposing of a sulfatase: A new Michaelis complex leads to efficient transition state charge offset.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
7QE2
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BU of 7qe2 by Molmil
Crystal structure of D-glucuronic acid bound to SN243
Descriptor: ACETATE ION, SN243, SULFATE ION, ...
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-01
Release date:2022-10-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7QG4
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BU of 7qg4 by Molmil
Apo crystal structure of a mutant of SN243 (D415N)
Descriptor: SN243, SULFATE ION, ZINC ION
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-07
Release date:2022-10-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7QEF
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BU of 7qef by Molmil
Crystal structure of para-nitrophenyl-Beta-D-glucuronide bound to a mutant of SN243 (D415A)
Descriptor: 4-nitrophenyl beta-D-glucopyranosiduronic acid, ACETATE ION, SN243, ...
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-02
Release date:2022-10-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.41 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7QEA
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BU of 7qea by Molmil
Crystal structure of fluorescein-di-Beta-D-glucuronide bound to a mutant of SN243 (D415A)
Descriptor: (2~{S},3~{S},4~{S},5~{R},6~{S})-3,4,5-tris(oxidanyl)-6-[(1~{R})-6'-oxidanyl-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-3'-yl]oxy-oxane-2-carboxylic acid, ACETATE ION, SN243, ...
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-01
Release date:2022-10-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7QE1
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BU of 7qe1 by Molmil
Crystal structure of apo SN243
Descriptor: SN243, ZINC ION
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-01
Release date:2022-10-12
Last modified:2023-03-29
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7QEE
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BU of 7qee by Molmil
SN243 mutant D415N bound to para-nitrophenyl-Beta-D-glucuronide
Descriptor: 4-nitrophenyl beta-D-glucopyranosiduronic acid, SN243, SULFATE ION, ...
Authors:Neun, S, Brear, P, Campbell, E, Omari, K, Wagner, O, Hyvonen, M, Hollfelder, F.
Deposit date:2021-12-02
Release date:2022-11-16
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.374 Å)
Cite:Functional metagenomic screening identifies an unexpected beta-glucuronidase.
Nat.Chem.Biol., 18, 2022
7JKA
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BU of 7jka by Molmil
m3DLH
Descriptor: m3DLH protein
Authors:Schnettler Fernandez, J.D.F, Campbell, E.C, Hollfelder, F.H.
Deposit date:2020-07-28
Release date:2021-08-04
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:m3DLH
To Be Published

 

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