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1B3U
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BU of 1b3u by Molmil
CRYSTAL STRUCTURE OF CONSTANT REGULATORY DOMAIN OF HUMAN PP2A, PR65ALPHA
Descriptor: PROTEIN (PROTEIN PHOSPHATASE PP2A)
Authors:Groves, M.R, Hanlon, N, Turowski, P, Hemmings, B, Barford, D.
Deposit date:1998-12-14
Release date:1999-04-12
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The structure of the protein phosphatase 2A PR65/A subunit reveals the conformation of its 15 tandemly repeated HEAT motifs.
Cell(Cambridge,Mass.), 96, 1999
1BZJ
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BU of 1bzj by Molmil
Human ptp1b complexed with tpicooh
Descriptor: 6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBOXYLIC ACID, PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE)
Authors:Groves, M.R, Yao, Z.-J, Barford Jr, D.T.B.
Deposit date:1998-10-29
Release date:1999-02-16
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
1BZH
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BU of 1bzh by Molmil
Cyclic peptide inhibitor of human PTP1B
Descriptor: PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE 1B INHIBITOR), PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE 1B)
Authors:Groves, M.R, Yao, Z.J, Burke Jr, T.R, Barford, D.
Deposit date:1998-10-28
Release date:1999-02-16
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
1BZC
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BU of 1bzc by Molmil
HUMAN PTP1B CATALYTIC DOMAIN COMPLEXED WITH TPI
Descriptor: 4-CARBAMOYL-4-{[6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBONYL]-AMINO}-BUTYRIC ACID, PROTEIN (PROTEIN-TYROSINE-PHOSPHATASE)
Authors:Groves, M.R, Yao, Z.J, Jr Burke, T.R, Barford, D.
Deposit date:1998-10-27
Release date:1999-02-16
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structural basis for inhibition of the protein tyrosine phosphatase 1B by phosphotyrosine peptide mimetics.
Biochemistry, 37, 1998
7O9T
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BU of 7o9t by Molmil
Crystal structure of Human Menin in apo form
Descriptor: 1,2-ETHANEDIOL, Menin
Authors:Groves, M.R, Gao, K.
Deposit date:2021-04-17
Release date:2022-07-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.159 Å)
Cite:Crystal structure of Human Menin in apo form
To Be Published
7O9X
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BU of 7o9x by Molmil
Crystal structure of Human Menin with fragment 16
Descriptor: (2-methoxyphenyl)methanamine, 1,2-ETHANEDIOL, GLYCEROL, ...
Authors:Groves, M.R, Gao, K.
Deposit date:2021-04-17
Release date:2022-07-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.299 Å)
Cite:Crystal structure of Human Menin with fragment 16
To Be Published
7O9Z
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BU of 7o9z by Molmil
Crystal structure of Human Menin in complex with BD-08
Descriptor: (~{E})-2-cyano-3-(2~{H}-indazol-6-yl)-~{N}-(2-morpholin-4-ylethyl)prop-2-enamide, 1,2-ETHANEDIOL, GLYCEROL, ...
Authors:Groves, M.R, Gao, K.
Deposit date:2021-04-18
Release date:2022-07-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.979 Å)
Cite:Crystal structure of Human Menin in complex with BD-08
To Be Published
7OA9
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BU of 7oa9 by Molmil
Crystal structure of Human Menin in complex with Fragment 21
Descriptor: (~{E})-2-cyano-3-(4-hydroxyphenyl)-~{N}-(2-morpholin-4-ylethyl)prop-2-enamide, 1,2-ETHANEDIOL, GLYCEROL, ...
Authors:Groves, M.R, Gao, K.
Deposit date:2021-04-19
Release date:2022-08-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.098 Å)
Cite:Crystal structure of Human Menin in complex with Fragment 21
To Be Published
1CZI
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BU of 1czi by Molmil
CHYMOSIN COMPLEX WITH THE INHIBITOR CP-113972
Descriptor: CHYMOSIN, CP-113972 (NORSTATINE-S-METHYL CYSTEINE-IODO-PHENYLALANINE-PROLINE)
Authors:Groves, M.R, Dhanaraj, V, Pitts, J.E, Badasso, M, Hoover, D, Nugent, P, Blundell, T.L.
Deposit date:1997-01-15
Release date:1997-04-01
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:A 2.3 A resolution structure of chymosin complexed with a reduced bond inhibitor shows that the active site beta-hairpin flap is rearranged when compared with the native crystal structure.
Protein Eng., 11, 1998
1PCI
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BU of 1pci by Molmil
PROCARICAIN
Descriptor: PROCARICAIN
Authors:Groves, M.R, Taylor, M.A.J, Scott, M, Cummings, N.J, Pickersgill, R.W, Jenkins, J.A.
Deposit date:1996-06-28
Release date:1997-04-01
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:The prosequence of procaricain forms an alpha-helical domain that prevents access to the substrate-binding cleft.
Structure, 4, 1996
2OB1
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BU of 2ob1 by Molmil
ppm1 with 1,8-ANS
Descriptor: Leucine carboxyl methyltransferase 1, PHOSPHATE ION
Authors:Groves, M.R.
Deposit date:2006-12-18
Release date:2007-01-30
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A method for the general identification of protein crystals in crystallization experiments using a noncovalent fluorescent dye.
Acta Crystallogr.,Sect.D, 63, 2007
2OB2
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BU of 2ob2 by Molmil
ppm1 in the absence of 1,8-ANS (cf 1JD)
Descriptor: GLYCEROL, Leucine carboxyl methyltransferase 1, PHOSPHATE ION, ...
Authors:Groves, M.R, Mueller, I.B, Kreplin, X, Mueller-Dieckmann, J.
Deposit date:2006-12-18
Release date:2007-01-30
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:A method for the general identification of protein crystals in crystallization experiments using a noncovalent fluorescent dye.
Acta Crystallogr.,Sect.D, 63, 2007
6S2K
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BU of 6s2k by Molmil
Human Menin in complex with AJ21
Descriptor: Multiple endocrine neoplasia I, isoform CRA_b, ~{N}-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine
Authors:Groves, M.R, Gao, K.
Deposit date:2019-06-21
Release date:2021-01-13
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Human Menin in complex with AJ21
To Be Published
6SKV
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BU of 6skv by Molmil
Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH2)
Descriptor: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Groves, M.R, Wang, W, van Oosterwijk, N.
Deposit date:2019-08-16
Release date:2020-08-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Target diazotransfer reagents to label metalloenzymes
To Be Published
6SKS
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BU of 6sks by Molmil
Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH1)
Descriptor: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Groves, M.R, Wang, W, van Oosterwijk, N.
Deposit date:2019-08-16
Release date:2020-08-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Target diazotransfer reagents to label metalloenzymes
To Be Published
6SKT
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BU of 6skt by Molmil
Crystal structure of bovine carbonic anhydrase II in complex with a benzenesulfonamide-based ligand (SH0)
Descriptor: COPPER (II) ION, Carbonic anhydrase 2, GLYCEROL, ...
Authors:Groves, M.R, Wang, W, van Oosterwijk, N.
Deposit date:2019-08-16
Release date:2020-08-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Target diazotransfer reagents to label metalloenzymes
To Be Published
5NKZ
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BU of 5nkz by Molmil
Crystal structure of H. polymorpha ubiquitin conjugating enzyme Pex4p in complex with soluble domain of Pex22p
Descriptor: Peroxin 22, Ubiquitin-conjugating enzyme E2-21 kDa
Authors:Danda, N, Lunev, S, Ali, A, Groves, M.R, Williams, C.
Deposit date:2017-04-03
Release date:2018-01-24
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Structural insights into K48-linked ubiquitin chain formation by the Pex4p-Pex22p complex.
Biochem. Biophys. Res. Commun., 496, 2018
3K7Y
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BU of 3k7y by Molmil
Aspartate Aminotransferase of Plasmodium falciparum
Descriptor: ACETATE ION, Aspartate aminotransferase, PYRIDOXAL-5'-PHOSPHATE
Authors:Groves, M.R, Jordanova, R, Jain, R, Wrenger, C, Muller, I.B.
Deposit date:2009-10-13
Release date:2010-10-13
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Specific Inhibition of the Aspartate Aminotransferase of Plasmodium falciparum.
J.Mol.Biol., 405, 2011
6SU9
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BU of 6su9 by Molmil
Crystal structure of Plasmodium falciparum PdxK with ligands AMP-PNP and PL
Descriptor: 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
Authors:Groves, M.R, Gao, K, Wang, W.
Deposit date:2019-09-13
Release date:2019-10-23
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Crystal structure of Plasmodium falciparum PdxK with ligands AMP-PNP and PL.
Crystals, 2019
7ZST
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BU of 7zst by Molmil
Crystal Structure of truncated aspartate transcarbamoylase from Plasmodium falciparum in complex with FLA-01
Descriptor: 2-azanyl-~{N}-(2-methoxyethyl)-5-phenyl-thiophene-3-carboxamide, Aspartate carbamoyltransferase, GLYCEROL, ...
Authors:Wang, C, Zhang, B, Groves, M.R.
Deposit date:2022-05-08
Release date:2022-08-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Discovery of Small-Molecule Allosteric Inhibitors of Pf ATC as Antimalarials.
J.Am.Chem.Soc., 144, 2022
6HL7
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BU of 6hl7 by Molmil
Crystal structure of truncated aspartate transcarbamoylase from Plasmodium falciparum with mutated active site (R109A/K138A) and N-carbamoyl-L-phosphate bound
Descriptor: Aspartate transcarbamoylase, PHOSPHORIC ACID MONO(FORMAMIDE)ESTER
Authors:Bosch, S.S, Lunev, S, Wrenger, C, Groves, M.R.
Deposit date:2018-09-10
Release date:2018-09-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Molecular Target Validation of Aspartate Transcarbamoylase fromPlasmodium falciparumby Torin 2.
Acs Infect Dis., 6, 2020
8Q5Z
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BU of 8q5z by Molmil
Crystal structure of bovine Thiosulfate sulfurtransferase
Descriptor: SODIUM ION, Thiosulfate sulfurtransferase
Authors:Goor, H.v, Groves, M.R, AL-Dahmani, Z.M, Wang, C.
Deposit date:2023-08-10
Release date:2023-09-20
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Crystal structure of bovine Thiosulfate sulfurtransferase
To Be Published
2W9Y
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BU of 2w9y by Molmil
The structure of the lipid binding protein Ce-FAR-7 from Caenorhabditis elegans
Descriptor: FATTY ACID/RETINOL BINDING PROTEIN PROTEIN 7, ISOFORM A, CONFIRMED BY TRANSCRIPT EVIDENCE, ...
Authors:Jordanova, R, Groves, M.R, Tucker, P.A.
Deposit date:2009-01-30
Release date:2009-10-20
Last modified:2015-04-29
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Fatty Acid and Retinoid Binding Proteins Have Distinct Binding Pockets for the Two Types of Cargo
J.Biol.Chem., 284, 2009
1MHN
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BU of 1mhn by Molmil
High resolution crystal structure of the SMN Tudor domain
Descriptor: Survival motor neuron protein
Authors:Sprangers, R, Groves, M.R, Sinning, I, Sattler, M.
Deposit date:2002-08-20
Release date:2003-03-25
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:High Resolution X-ray and NMR Structures of the SMN Tudor Domain: conformational variation in the binding site for symmetrically dimethylated arginine residues
J.Mol.Biol., 327, 2003
7ZP2
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BU of 7zp2 by Molmil
Crystal Structure of truncated aspartate transcarbamoylase from Plasmodium falciparum in complex with BDA-04
Descriptor: Aspartate carbamoyltransferase, SODIUM ION, SULFATE ION, ...
Authors:Wang, C, Zhang, B, Groves, M.R.
Deposit date:2022-04-26
Release date:2022-08-24
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.292 Å)
Cite:Discovery of Small-Molecule Allosteric Inhibitors of Pf ATC as Antimalarials.
J.Am.Chem.Soc., 144, 2022

 

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