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8VPO
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X-Ray Crystal Structure of TigE from Paramaledivibacter caminithermalis
分子名称: GLYCEROL, IRON/SULFUR CLUSTER, Radical SAM core domain-containing protein
著者Grove, T.L, Lachowicz, J.C, Zizola, C.
登録日2024-01-16
公開日2024-02-07
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Structural, Biochemical, and Bioinformatic Basis for Identifying Radical SAM Cyclopropyl Synthases.
Acs Chem.Biol., 19, 2024
8TLW
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Crystal structure of MBP and AF9 AHD fusion protein 3AQA in complex with peptidomimetic inhibitor 28
分子名称: MBP and AF9 AHD fusion protein 3AQA, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, peptidomimetic inhibitor 28
著者Yang, Y, Nikolovska-Coleska, Z.
登録日2023-07-27
公開日2024-05-29
実験手法X-RAY DIFFRACTION (2.106 Å)
主引用文献Structural studies of intrinsically disordered MLL-fusion protein AF9 in complex with peptidomimetic inhibitors.
Protein Sci., 33, 2024
8TLV
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Crystal structure of MBP and AF9 AHD fusion protein 4AQK in complex with peptidomimetic inhibitor 28
分子名称: GLUTATHIONE, MBP and AF9 AHD fusion protein 4AQK, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, ...
著者Yang, Y, Nikolovska-Coleska, Z.
登録日2023-07-27
公開日2024-05-29
実験手法X-RAY DIFFRACTION (2.659 Å)
主引用文献Structural studies of intrinsically disordered MLL-fusion protein AF9 in complex with peptidomimetic inhibitors.
Protein Sci., 33, 2024
8V2Y
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Room temperature X-ray Crystal Structure of FMN-bound long-chain flavodoxin from Rhodopseudomonas palustris
分子名称: FLAVIN MONONUCLEOTIDE, Flavodoxin
著者Ansari, A, Khan, S.A, Miller, A.F.
登録日2023-11-24
公開日2024-03-13
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.86 Å)
主引用文献Structure, dynamics, and redox reactivity of an all-purpose flavodoxin.
J.Biol.Chem., 300, 2024
8VRI
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E. coli peptidyl-prolyl cis-trans isomerase containing difluoro-leucines
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, NONAETHYLENE GLYCOL, ...
著者Frkic, R.L, Jackson, C.J.
登録日2024-01-22
公開日2024-05-22
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Conformational Preferences of the Non-Canonical Amino Acids (2 S ,4 S )-5-Fluoroleucine, (2 S ,4 R )-5-Fluoroleucine, and 5,5'-Difluoroleucine in a Protein.
Biochemistry, 63, 2024
8WWX
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Ube1L acts akin to a mitt, that mediates UbcH8 binding and orchestrates "E1-E2" interaction
分子名称: Ubiquitin-like modifier-activating enzyme 7
著者Dag, C, Elgin, E.S, Lee, W, Ziarek, J.J.
登録日2023-10-27
公開日2023-11-08
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Ube1L acts akin to a mitt, that mediates UbcH8 binding and orchestrates "E1-E2" interaction
To Be Published
8VJP
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Histidine-covalent stapled alpha-helical peptide (155H1) targeting hMcl-1
分子名称: (4Z)-oct-4-en-1-ol, (S~1~R)-3-carbamoyl-4-methoxybenzene-1-sulfinic acid, Histidine-covalent stapled alpha-helical peptide, ...
著者Muzzarelli, K.M, Assar, Z, Alboreggia, G, Pellecchia, M.
登録日2024-01-07
公開日2024-05-15
最終更新日2024-06-05
実験手法X-RAY DIFFRACTION (1.13 Å)
主引用文献Histidine-Covalent Stapled Alpha-Helical Peptides Targeting hMcl-1.
J.Med.Chem., 67, 2024
8Y4Z
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Monomeric HERC5 HECT c-lobe structure in solution
分子名称: E3 ISG15--protein ligase HERC5
著者Dag, C, Lambert, M, Kahraman, K, Lohn, F, Lee, W, Gocenler, O, Guntert, P, Dotsch, V.
登録日2024-01-31
公開日2024-02-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Monomeric HERC5 HECT c-lobe structure in solution
To Be Published
8X1H
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Crystal structure of N-terminal domain of Nucleocapsid protein of SARS-CoV-2
分子名称: GLYCEROL, Nucleoprotein
著者Kumari, S, Gupta, G.D.
登録日2023-11-07
公開日2023-11-22
最終更新日2024-07-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Unveiling potential inhibitors targeting the nucleocapsid protein of SARS-CoV-2: Structural insights into their binding sites.
Int.J.Biol.Macromol., 273, 2024
8UTX
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Solution structure of a 12-mer peptide bearing a bicyclic Asx motif mimic (BAMM) as a synthetic N-cap
分子名称: 1,3,5-tris(bromomethyl)benzene, TRP-CYS-ASP-ALA-ALA-CYS-CYS-ALA-ALA-ALA-LYS-ALA-NH2 peptide
著者Mi, T.X, Burgess, K.
登録日2023-10-31
公開日2024-06-05
実験手法SOLUTION NMR
主引用文献Bioinformatics leading to conveniently accessible, helix enforcing, bicyclic ASX motif mimics (BAMMs).
Nat Commun, 15, 2024
8X40
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Free VF16 in aqueous solution
分子名称: VAL-PRO-ILE-ILE-TYR-CYS-ASN-ARG-ARG-THR-DLY-LYS-CYS-GLN-ARG-PHE
著者Swaleeha, J, Bhattacharyya, S.
登録日2023-11-14
公開日2024-03-06
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure of Free VF16
To Be Published
8X3N
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Thanatin VF16 in complex with LPS
分子名称: VAL-PRO-ILE-ILE-TYR-CYS-ASN-ARG-ARG-THR-DLY-LYS-CYS-GLN-ARG-PHE
著者Swaleeha, J, Bhattacharyya, S.
登録日2023-11-14
公開日2024-03-06
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Thanatin VF16 in complex with LPS
To Be Published
5FSL
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MTH1 substrate recognition: Complex with a methylaminopurinone
分子名称: 7,8-DIHYDRO-8-OXOGUANINE TRIPHOSPHATASE, 9-METHYL-2-(METHYLAMINO)-1H-PURIN-6-ONE, SULFATE ION
著者Nissink, J.W.M, Bista, M, Breed, J, Carter, N, Embrey, K, Read, J, Phillips, C, Winter, J.J.
登録日2016-01-06
公開日2016-07-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献Mth1 Substrate Recognition--an Example of Specific Promiscuity.
Plos One, 11, 2016
5FSO
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MTH1 substrate recognition: Complex with a methylaminopyrimidinedione.
分子名称: 6-(METHYLAMINO)-1H-PYRIMIDINE-2,4-DIONE, 7,8-DIHYDRO-8-OXOGUANINE TRIPHOSPHATASE, ACETATE ION, ...
著者Nissink, J.W.M, Bista, M, Breed, J, Carter, N, Embrey, K, Read, J, Phillips, C, Winter, J.J.
登録日2016-01-06
公開日2017-01-18
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.67 Å)
主引用文献MTH1 Substrate Recognition--An Example of Specific Promiscuity.
PLoS ONE, 11, 2016
5FSN
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MTH1 substrate recognition: Complex with a aminomethylpyrimidinyl oxypropanol.
分子名称: 3-(2-AMINO-6-METHYL-PYRIMIDIN-4-YL)OXYPROPAN-1-OL, 7,8-DIHYDRO-8-OXOGUANINE TRIPHOSPHATASE, ACETATE ION, ...
著者Nissink, J.W.M, Bista, M, Breed, J, Carter, N, Embrey, K, Read, J, Phillips, C, Winter, J.J.
登録日2016-01-06
公開日2016-07-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Mth1 Substrate Recognition--an Example of Specific Promiscuity.
Plos One, 11, 2016
7U3G
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GID4 in complex with compound 67
分子名称: (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-5-amine, Glucose-induced degradation protein 4 homolog
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.244 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
7U3K
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GID4 in complex with compound 89
分子名称: GLYCEROL, Glucose-induced degradation protein 4 homolog, N-butylglycyl-4-tert-butyl-D-phenylalanyl-3-methoxy-N-methyl-L-phenylalaninamide
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.198 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
7U3I
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GID4 in complex with compound 16
分子名称: 3-{[(5S)-5-methyl-4,5-dihydro-1,3-thiazol-2-yl]amino}phenol, GLYCEROL, Glucose-induced degradation protein 4 homolog
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.991 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
7U3J
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GID4 in complex with compound 88
分子名称: (2S)-2-{[(2S)-2-({N-[(2,4-dimethoxyphenyl)methyl]glycyl}amino)-2-(thiophen-2-yl)acetyl]amino}-N-methyl-4-phenylbutanamide, GLYCEROL, Glucose-induced degradation protein 4 homolog
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.642 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
5EJ0
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BU of 5ej0 by Molmil
The vaccinia virus H3 envelope protein, a major target of neutralizing antibodies, exhibits a glycosyltransferase fold and binds UDP-Glucose
分子名称: 1,2-ETHANEDIOL, 1,3-PROPANDIOL, 2-(2-METHOXYETHOXY)ETHANOL, ...
著者Singh, K, Gittis, A.G, Gitti, R.K, Ostazesky, S.A, Su, H.P, Garboczi, D.N.
登録日2015-10-30
公開日2016-03-16
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献The Vaccinia Virus H3 Envelope Protein, a Major Target of Neutralizing Antibodies, Exhibits a Glycosyltransferase Fold and Binds UDP-Glucose.
J.Virol., 90, 2016
5EH6
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Crystal Structure of the Glycophorin A Transmembrane Monomer in Lipidic Cubic Phase
分子名称: Glycophorin-A
著者Call, M.J, Call, M.E, Trenker, R.
登録日2015-10-28
公開日2015-12-23
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.918 Å)
主引用文献Crystal Structure of the Glycophorin A Transmembrane Dimer in Lipidic Cubic Phase.
J.Am.Chem.Soc., 137, 2015
5EH4
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Crystal Structure of the Glycophorin A Transmembrane Dimer in Lipidic Cubic Phase
分子名称: (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, Glycophorin-A
著者Call, M.J, Call, M.E, Trenker, R.
登録日2015-10-28
公開日2015-12-23
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Crystal Structure of the Glycophorin A Transmembrane Dimer in Lipidic Cubic Phase.
J.Am.Chem.Soc., 137, 2015
7U3E
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GID4 in complex with compound 1
分子名称: Glucose-induced degradation protein 4 homolog, tert-butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.852 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
7U3F
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GID4 in complex with compound 4
分子名称: (4R)-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine, GLYCEROL, Glucose-induced degradation protein 4 homolog
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022
7U3H
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GID4 in complex with compound 7
分子名称: (5R)-N-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine, Glucose-induced degradation protein 4 homolog
著者Chana, C.K, Sicheri, F.
登録日2022-02-27
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.798 Å)
主引用文献Discovery and Structural Characterization of Small Molecule Binders of the Human CTLH E3 Ligase Subunit GID4.
J.Med.Chem., 65, 2022

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件を2024-07-17に公開中

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