PDB: 31489 件ウェブページステータス検索Chemie searchBIRD

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6EEE	X-ray crystal structure of Pf-M17 in complex with inhibitor (6k) and regulatory zinc ion 分子名称: (1R,2r,3S,5R,7R)-N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]tricyclo[3.3.1.1~3,7~]decane-2-carboxamide, 1,2-ETHANEDIOL, CARBONATE ION, ... 著者 Drinkwater, N, McGowan, S. 登録日 2018-08-13 公開日 2018-12-26 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Hydroxamic Acid Inhibitors Provide Cross-Species Inhibition of Plasmodium M1 and M17 Aminopeptidases. J. Med. Chem., 62, 2019
6KNI	Crystal structure of SbnH in complex with the cofactor PLP, a PLP-dependent decarboxylase in Staphyloferrin B biothesynthesis 分子名称: PYRIDOXAL-5'-PHOSPHATE, Probable diaminopimelate decarboxylase protein 著者 Tang, J, Ju, Y, Zhou, H. 登録日 2019-08-05 公開日 2019-11-13 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.97 Å) 主引用文献 Structural Insights into Substrate Recognition and Activity Regulation of the Key Decarboxylase SbnH in Staphyloferrin B Biosynthesis. J.Mol.Biol., 431, 2019
6EH7	F11 Human T-Cell Receptor specific for influenza virus haaemagglutinin epitope PKYVKQNTLKLAT carried by Human Leukocyte Antigen HLA-DR0101 分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Human T Cell Receptor Alpha Chain, ... 著者 Rizkallah, P.J, Cole, D.K. 登録日 2017-09-12 公開日 2018-04-18 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 In Silicoand Structural Analyses Demonstrate That Intrinsic Protein Motions Guide T Cell Receptor Complementarity Determining Region Loop Flexibility. Front Immunol, 9, 2018
6JTO	Crystal structure of HLA-C05 in complex with a tumor mut10m peptide 分子名称: 10-mer peptide, Beta-2-microglobulin, HLA class I histocompatibility antigen, ... 著者 Bai, P, Zhou, Q, Wei, P, Lei, Y. 登録日 2019-04-11 公開日 2020-04-15 最終更新日 2021-05-19 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Rational discovery of a cancer neoepitope harboring the KRAS G12D driver mutation. Sci China Life Sci, 2021
6EJE	Human Xylosyltransferase 1 in complex with peptide PAAEGSGEQDFT 分子名称: PHOSPHATE ION, SODIUM ION, Syndecan-1, ... 著者 Briggs, D.C, Hohenester, E. 登録日 2017-09-20 公開日 2018-05-02 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (2.43 Å) 主引用文献 Structural Basis for the Initiation of Glycosaminoglycan Biosynthesis by Human Xylosyltransferase 1. Structure, 26, 2018
6EIX	Crystal structure of the kinase domain of the Q207E mutant of ACVR1 (ALK2) in complex with a 2-aminopyridine inhibitor K02288 分子名称: 1,2-ETHANEDIOL, 3-[6-amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol, Activin receptor type-1 著者 Williams, E.P, Canning, P, Sanvitale, C.E, Krojer, T, Allerston, C.K, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Bullock, A.N. 登録日 2017-09-19 公開日 2017-09-27 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Crystal structure of the kinase domain of the Q207E mutant of ACVR1 (ALK2) in complex with K02288 To be published
6EJ8	Human Xylosyltransferase 1 in complex with peptide QEEEGSGGGQGG 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, PHOSPHATE ION, Protein AMBP, ... 著者 Briggs, D.C, Hohenester, E. 登録日 2017-09-20 公開日 2018-05-02 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (2.09 Å) 主引用文献 Structural Basis for the Initiation of Glycosaminoglycan Biosynthesis by Human Xylosyltransferase 1. Structure, 26, 2018
6JWM	Crystal structure of the SPRY domain of SPSB2 in complex with cR7, a potent cyclic peptide inhibitor of SPSB2-iNOS interaction 分子名称: Nitric oxide synthase, inducible, SPRY domain-containing SOCS box protein 2 著者 Li, K, Kuang, Z. 登録日 2019-04-21 公開日 2020-04-22 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (1.23 Å) 主引用文献 Crystal structure of SPSB2 in complex with cR7, a potent cyclic peptide inhibitor of SPSB2-iNOS interaction To Be Published
6ESD	Crystal structure of L-tryptophan oxidase VioA from Chromobacterium violaceum 分子名称: CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, Flavin-dependent L-tryptophan oxidase VioA 著者 Lai, H.E, Morgan, M, Moore, S, Freemont, P. 登録日 2017-10-20 公開日 2017-12-06 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 A semi-synthetic strategy for derivatization of the violacein natural product scaffold Biorxiv, 2017
6E58	Crystal structure of Streptococcus pyogenes endo-beta-N-acetylglucosaminidase (EndoS2) 分子名称: CALCIUM ION, Secreted Endo-beta-N-acetylglucosaminidase (EndoS) 著者 Klontz, E.H, Trastoy, B, Gunther, S, Guerin, M.E, Sundberg, E.J. 登録日 2018-07-19 公開日 2019-02-06 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Molecular Basis of Broad SpectrumN-Glycan Specificity and Processing of Therapeutic IgG Monoclonal Antibodies by Endoglycosidase S2. ACS Cent Sci, 5, 2019
6JZS	Structure of the Manganese Protoporphyrin IX-Reconstituted CYP102A1 Haem Domain with N-Abietoyl-L-Tryptophan in complex with Pyridine 分子名称: (2S)-2-[[(1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-1-yl]carbonylamino]-3-( 1H-indol-3-yl)propanoic acid, Bifunctional cytochrome P450/NADPH--P450 reductase, GLYCEROL, ... 著者 Stanfield, J.K, Omura, K, Matsumoto, A, Kasai, C, Sugimoto, H, Shiro, Y, Watanabe, Y, Shoji, O. 登録日 2019-05-03 公開日 2020-03-18 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 Crystals in Minutes: Instant On-Site Microcrystallisation of Various Flavours of the CYP102A1 (P450BM3) Haem Domain. Angew.Chem.Int.Ed.Engl., 59, 2020
6K0V	Catalytic domain of GH87 alpha-1,3-glucanase D1069A in complex with tetrasaccharides 分子名称: Alpha-1,3-glucanase, CALCIUM ION, SULFATE ION, ... 著者 Itoh, T, Intuy, R, Suyotha, W, Hayashi, J, Yano, S, Makabe, K, Wakayama, M, Hibi, T. 登録日 2019-05-07 公開日 2019-12-25 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.504 Å) 主引用文献 Structural insights into substrate recognition and catalysis by glycoside hydrolase family 87 alpha-1,3-glucanase from Paenibacillus glycanilyticus FH11. Febs J., 287, 2020
6E6V	The N-terminal domain of PA endonuclease from the influenza H1N1 virus in complex with 3-hydroxy-6-methyl-4-oxo-1,4-dihydropyridine-2-carboxylic acid 分子名称: 1,2-ETHANEDIOL, 3-hydroxy-6-methyl-4-oxo-1,4-dihydropyridine-2-carboxylic acid, MANGANESE (II) ION, ... 著者 Dick, B.L, Morrison, C.N, Credille, C.V, Cohen, S.M. 登録日 2018-07-25 公開日 2019-07-31 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 SAR Exploration of Tight-Binding Inhibitors of Influenza Virus PA Endonuclease. J.Med.Chem., 62, 2019
6E8R	Structure of the SNX32 PX domain in complex with Chlamydial protein IncE in space group I121 分子名称: IncE, Sorting nexin-32 著者 Paul, B, Collins, B. 登録日 2018-07-31 公開日 2018-09-26 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.268 Å) 主引用文献 Crystal structure of the SNX32 PX domain in complex with the Chlamydia trachomatis inclusion protein IncE To be Published
6EA1	X-ray crystal structure of Pf-M1 in complex with inhibitor (6da) and catalytic zinc ion 分子名称: (2R)-2,3,3,3-tetrafluoro-N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]propanamide, GLYCEROL, M1 family aminopeptidase, ... 著者 Drinkwater, N, McGowan, S. 登録日 2018-08-02 公開日 2018-12-26 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.815 Å) 主引用文献 Hydroxamic Acid Inhibitors Provide Cross-Species Inhibition of Plasmodium M1 and M17 Aminopeptidases. J. Med. Chem., 62, 2019
6E8S	Structure of the iMango-III aptamer bound to TO1-Biotin 分子名称: 4-[(3-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-1,3-benzothiazol-3-ium-2-yl)methyl]-1-methylquinolin-1-ium, MAGNESIUM ION, POTASSIUM ION, ... 著者 Trachman, R.J, Ferre-D'Amare, A.R. 登録日 2018-07-31 公開日 2019-04-17 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Structure and functional reselection of the Mango-III fluorogenic RNA aptamer. Nat. Chem. Biol., 15, 2019
6E9W	Crystal structure of Rock1 with a pyridinylbenzamide based inhibitor 分子名称: N-[(2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-4-(pyridin-4-yl)benzamide, Rho-associated protein kinase 1, SULFATE ION 著者 Judge, R.A, Hobson, A.D. 登録日 2018-08-01 公開日 2018-11-14 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.96 Å) 主引用文献 Identification of Selective Dual ROCK1 and ROCK2 Inhibitors Using Structure Based Drug Design. J. Med. Chem., 61, 2018
6K6M	Crystal structure of HIV-2 Nef protein 分子名称: Protein Nef 著者 Hirao, K, Andrews, S, Kuroki, K, Kusaka, H, Tadokoro, T, Kita, S, Ose, T, Rowland-Jones, S, Maenaka, K. 登録日 2019-06-04 公開日 2020-03-25 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.072 Å) 主引用文献 Structure of HIV-2 Nef Reveals Features Distinct from HIV-1 Involved in Immune Regulation. Iscience, 23, 2020
6EA9	Structure of VACV Poxin in post-reactive state with Gp[2'-5']Ap[3'] 分子名称: 2',5'-GpAp, Protein B2 著者 Eaglesham, J.B, Kranzusch, P.J. 登録日 2018-08-02 公開日 2019-02-06 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Viral and metazoan poxins are cGAMP-specific nucleases that restrict cGAS-STING signalling. Nature, 566, 2019
6EAL	CRYSTAL STRUCTURE OF HUMAN RESPIRATORY SYNCYTIAL VIRUS FUSION GLYCOPROTEIN INHIBITOR ESCAPE VARIANT D486N STABILIZED IN THE PREFUSION STATE 分子名称: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, D(-)-TARTARIC ACID, Fusion glycoprotein F0, ... 著者 Battles, M.B, McLellan, J.S. 登録日 2018-08-03 公開日 2019-08-07 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (2.751 Å) 主引用文献 Structural Basis for Respiratory Syncytial Virus Fusion Inhibitor Resistance To be published
6EAZ	Apo structure of the mitochondrial calcium uniporter protein MICU2 分子名称: Calcium uptake protein 2, mitochondrial, GLYCEROL 著者 Kamer, K.J, Grabarek, Z. 登録日 2018-08-03 公開日 2019-02-13 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.504 Å) 主引用文献 Crystal structure of MICU2 and comparison with MICU1 reveal insights into the uniporter gating mechanism. Proc. Natl. Acad. Sci. U.S.A., 116, 2019
6K8K	Crystal structure of Arabidopsis thaliana BIC2-CRY2 complex 分子名称: ADENOSINE MONOPHOSPHATE, Cryptochrome-2, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Wang, X, Ma, L, Guan, Z, Yin, P. 登録日 2019-06-12 公開日 2020-05-13 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structural insights into BIC-mediated inactivation of Arabidopsis cryptochrome 2. Nat.Struct.Mol.Biol., 27, 2020
6EB9	Crystal Structure of the Nipah Virus Phosphoprotein Multimerization Domain Delta 542-544 分子名称: Phosphoprotein 著者 Bruhn, J.F, Saphire, E.O. 登録日 2018-08-06 公開日 2019-03-13 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 A Conserved Basic Patch and Central Kink in the Nipah Virus Phosphoprotein Multimerization Domain Are Essential for Polymerase Function. Structure, 27, 2019
6EAI	CRYSTAL STRUCTURE OF HUMAN RESPIRATORY SYNCYTIAL VIRUS FUSION GLYCOPROTEIN INHIBITOR ESCAPE VARIANT S398L STABILIZED IN THE PREFUSION STATE 分子名称: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, D(-)-TARTARIC ACID, ... 著者 Battles, M.B, McLellan, J.S. 登録日 2018-08-03 公開日 2019-08-07 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Structural Basis for Respiratory Syncytial Virus Fusion Inhibitor Resistance To be published
6ECF	Vlm2 thioesterase domain with genetically encoded 2,3-diaminopropionic acid bound with a dodecadepsipeptide, space group P1 分子名称: Vlm2, dodecadepsipeptide 著者 Alonzo, D.A, Huguenin-Dezot, N, Heberlig, G.W, Mahesh, M, Nguyen, D.P, Dornan, M.H, Boddy, C.N, Chin, J.W, Schmeing, T.M. 登録日 2018-08-07 公開日 2018-12-12 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Trapping biosynthetic acyl-enzyme intermediates with encoded 2,3-diaminopropionic acid. Nature, 565, 2019

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