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4QO4
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BU of 4qo4 by Molmil
co-crystal structure of MDM2 (17-111) with compound 16, {(3R,5R,6S)-5-(3-CHLOROPHENYL)-6-(4-CHLOROPHENYL)-1-[(1S)-1-(6-CYCLOPROPYLPYRIDIN-2-YL)PROPYL]-3-METHYL-2-OXOPIPERIDIN-3-YL}ACETIC ACID
Descriptor: E3 ubiquitin-protein ligase Mdm2, {(3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-[(1S)-1-(6-cyclopropylpyridin-2-yl)propyl]-3-methyl-2-oxopiperidin-3-yl}acetic acid
Authors:Huang, X.
Deposit date:2014-06-19
Release date:2014-07-16
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Discovery of Potent and Simplified Piperidinone-Based Inhibitors of the MDM2-p53 Interaction.
ACS Med Chem Lett, 5, 2014
7S8U
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BU of 7s8u by Molmil
Cryo-EM structure of a mammalian peptide transporter (PepT1/slc15a1) in nanodisc
Descriptor: Solute carrier family 15 member 1
Authors:Shen, J, Zhou, M.
Deposit date:2021-09-19
Release date:2022-07-20
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Extracellular domain of PepT1 interacts with TM1 to facilitate substrate transport.
Structure, 30, 2022
4WT2
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BU of 4wt2 by Molmil
Co-crystal Structure of MDM2 in Complex with AM-7209
Descriptor: 4-({[(3R,5R,6S)-1-[(1S)-2-(tert-butylsulfonyl)-1-cyclopropylethyl]-6-(4-chloro-3-fluorophenyl)-5-(3-chlorophenyl)-3-methyl-2-oxopiperidin-3-yl]acetyl}amino)-2-methoxybenzoic acid, E3 ubiquitin-protein ligase Mdm2, SULFATE ION
Authors:Shaffer, P.L, Huang, X, Yakowec, P, Long, A.M.
Deposit date:2014-10-30
Release date:2014-12-03
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:Discovery of AM-7209, a Potent and Selective 4-Amidobenzoic Acid Inhibitor of the MDM2-p53 Interaction.
J.Med.Chem., 57, 2014
6XRM
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BU of 6xrm by Molmil
Crystal structure of human PI3K-gamma in complex with Compound 4
Descriptor: 5-[2-amino-3-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-2-[(1S)-1-cyclopropylethyl]-7-(trifluoromethyl)-2,3-dihydro-1H-isoindol-1-one, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION
Authors:Walker, N.P, Jeffrey, J.L.
Deposit date:2020-07-13
Release date:2020-09-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.88 Å)
Cite:Discovery of Potent and Selective PI3K gamma Inhibitors.
J.Med.Chem., 63, 2020
6XRN
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BU of 6xrn by Molmil
Crystal structure of human PI3K-gamma in complex with Compound 17
Descriptor: 2-amino-5-{2-[(1S)-1-cyclopropylethyl]-7-methyl-1-oxo-2,3-dihydro-1H-isoindol-5-yl}-N-(trans-3-hydroxycyclobutyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
Authors:Walker, N.P, Jeffrey, J.L.
Deposit date:2020-07-13
Release date:2021-11-03
Last modified:2022-02-09
Method:X-RAY DIFFRACTION (2.96 Å)
Cite:Design, Synthesis, and Structure-Activity Relationship Optimization of Pyrazolopyrimidine Amide Inhibitors of Phosphoinositide 3-Kinase gamma (PI3K gamma ).
J.Med.Chem., 65, 2022
4AI5
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BU of 4ai5 by Molmil
Crystal structure of Y16F of 3-methyladenine DNA glycosylase I (TAG) in complex with 3-methyladenine
Descriptor: 3-METHYL-3H-PURIN-6-YLAMINE, DNA-3-METHYLADENINE GLYCOSYLASE I, SULFATE ION, ...
Authors:Zhu, X, Naismith, J.H.
Deposit date:2012-02-08
Release date:2012-02-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:A Model for 3-Methyladenine Recognition by 3-Methyladenine DNA Glycosylase I (Tag) from Staphylococcus Aureus.
Acta Crystallogr.,Sect.F, 68, 2012
2VXZ
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BU of 2vxz by Molmil
Crystal Structure of hypothetical protein PyrSV_gp04 from Pyrobaculum spherical virus
Descriptor: CHLORIDE ION, GLYCEROL, PYRSV_GP04
Authors:Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, Oke, M, Naismith, J.H, White, M.F.
Deposit date:2008-07-15
Release date:2009-11-17
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2VW8
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BU of 2vw8 by Molmil
Crystal Structure of Quinolone signal response protein pqsE from Pseudomonas aeruginosa
Descriptor: 1,2-ETHANEDIOL, CACODYLATE ION, FE (II) ION, ...
Authors:Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, Oke, M, Naismith, J.H, White, M.F.
Deposit date:2008-06-17
Release date:2010-07-14
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
4AI4
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BU of 4ai4 by Molmil
crystal structure of E38Q mutant of 3-methyladenine DNA glycosylase I from Staphylococcus aureus
Descriptor: DNA-3-METHYLADENINE GLYCOSYLASE I, SULFATE ION, ZINC ION
Authors:Zhu, X, Naismith, J.H.
Deposit date:2012-02-08
Release date:2012-02-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:A Model for 3-Methyladenine Recognition by 3-Methyladenine DNA Glycosylase I (Tag) from Staphylococcus Aureus.
Acta Crystallogr.,Sect.F, 68, 2012
2WJ9
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BU of 2wj9 by Molmil
ArdB
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, BETA-MERCAPTOETHANOL, CHLORIDE ION, ...
Authors:Weikart, N.D, Roberts, G, Johnson, K.A, Oke, M, Cooper, L.P, McMahon, S.A, White, J.H, Liu, H, Carter, L.G, Walkinshaw, M.D, Blakely, G.W, Naismith, J.H, Dryden, D.T.F.
Deposit date:2009-05-25
Release date:2010-08-18
Last modified:2018-05-02
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X48
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BU of 2x48 by Molmil
ORF 55 from Sulfolobus islandicus rudivirus 1
Descriptor: CAG38821, PHOSPHATE ION
Authors:Oke, M, Carter, L, Johnson, K.A, Liu, H, Mcmahon, S, Naismith, J.H, White, M.F.
Deposit date:2010-01-28
Release date:2010-07-21
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X4H
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BU of 2x4h by Molmil
Crystal Structure of the hypothetical protein SSo2273 from Sulfolobus solfataricus
Descriptor: HYPOTHETICAL PROTEIN SSO2273, ZINC ION
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-01-31
Release date:2010-07-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X4K
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BU of 2x4k by Molmil
Crystal structure of SAR1376, a putative 4-oxalocrotonate tautomerase from the methicillin-resistant Staphylococcus aureus (MRSA)
Descriptor: 4-OXALOCROTONATE TAUTOMERASE, ACETATE ION, PHOSPHATE ION, ...
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-01
Release date:2010-07-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X5D
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BU of 2x5d by Molmil
Crystal Structure of a probable aminotransferase from Pseudomonas aeruginosa
Descriptor: PROBABLE AMINOTRANSFERASE, PYRIDOXAL-5'-PHOSPHATE, SULFATE ION
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-08
Release date:2010-07-21
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genom., 11, 2010
2X3N
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BU of 2x3n by Molmil
Crystal structure of pqsL, a probable FAD-dependent monooxygenase from Pseudomonas aeruginosa
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, PROBABLE FAD-DEPENDENT MONOOXYGENASE
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-01-25
Release date:2010-07-21
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X4J
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BU of 2x4j by Molmil
Crystal structure of ORF137 from Pyrobaculum spherical virus
Descriptor: HYPOTHETICAL PROTEIN ORF137
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-01
Release date:2010-07-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X5F
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BU of 2x5f by Molmil
Crystal structure of the methicillin-resistant Staphylococcus aureus Sar2028, an aspartate_tyrosine_phenylalanine pyridoxal-5'-phosphate dependent aminotransferase
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ASPARTATE_TYROSINE_PHENYLALANINE PYRIDOXAL-5' PHOSPHATE-DEPENDENT AMINOTRANSFERASE, MAGNESIUM ION, ...
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-08
Release date:2010-07-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genom., 11, 2010
2X3L
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BU of 2x3l by Molmil
Crystal Structure of the Orn_Lys_Arg decarboxylase family protein SAR0482 from Methicillin-resistant Staphylococcus aureus
Descriptor: 1,2-ETHANEDIOL, ORN/LYS/ARG DECARBOXYLASE FAMILY PROTEIN, PYRIDOXAL-5'-PHOSPHATE, ...
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-01-25
Release date:2010-07-21
Last modified:2015-11-11
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X4G
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BU of 2x4g by Molmil
Crystal structure of PA4631, a nucleoside-diphosphate-sugar epimerase from Pseudomonas aeruginosa
Descriptor: NUCLEOSIDE-DIPHOSPHATE-SUGAR EPIMERASE
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-01-30
Release date:2010-07-21
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X5C
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BU of 2x5c by Molmil
Crystal structure of hypothetical protein ORF131 from Pyrobaculum Spherical Virus
Descriptor: GLYCEROL, HYPOTHETICAL PROTEIN ORF131, ZINC ION
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-08
Release date:2010-07-21
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genom., 11, 2010
2X5Q
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BU of 2x5q by Molmil
Crystal Structure of Hypothetical protein sso1986 from Sulfolobus solfataricus P2
Descriptor: SSO1986
Authors:Oke, M, Carter, L, Johnson, K.A, Kerou, M, Liu, H, Mcmahon, S, Naismith, J.H, White, M.F.
Deposit date:2010-02-10
Release date:2010-07-28
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X5R
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BU of 2x5r by Molmil
Crystal Structure of the hypothetical protein ORF126 from Pyrobaculum spherical virus
Descriptor: HYPOTHETICAL PROTEIN ORF126, ZINC ION
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-10
Release date:2010-07-28
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X5P
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BU of 2x5p by Molmil
Crystal structure of the Streptococcus pyogenes fibronectin binding protein Fbab-B
Descriptor: FIBRONECTIN BINDING PROTEIN
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-02-10
Release date:2010-09-01
Last modified:2019-10-30
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X4I
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BU of 2x4i by Molmil
ORF 114a from Sulfolobus islandicus rudivirus 1
Descriptor: UNCHARACTERIZED PROTEIN 114
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, Naismith, J.H, White, M.F.
Deposit date:2010-01-31
Release date:2010-07-21
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010
2X3M
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BU of 2x3m by Molmil
Crystal Structure of Hypothetical Protein ORF239 from Pyrobaculum Spherical Virus
Descriptor: HYPOTHETICAL PROTEIN ORF239
Authors:Oke, M, Carter, L.G, Johnson, K.A, Liu, H, Mcmahon, S.A, White, M.F, Naismith, J.H.
Deposit date:2010-01-25
Release date:2011-02-16
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:The Scottish Structural Proteomics Facility: Targets, Methods and Outputs.
J.Struct.Funct.Genomics, 11, 2010

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