PDB: 68717 件ウェブページステータス検索Chemie searchBIRD

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5R36	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 30, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (1.008 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3M	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 46, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.038 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R1U	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry B03, DMSO-free 分子名称: 2-[(1R)-1-aminopropyl]phenol, Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.039 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R27	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry G03, DMSO-free 分子名称: 3-ethoxybenzene-1-carboximidamide, Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (1.029 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2M	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 10, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.008 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R32	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 26, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (0.9 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3K	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 44, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.207 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3Z	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 59, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.067 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R1Z	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry D11, DMSO-free 分子名称: 3-(1,3-thiazol-2-yl)propanoic acid, Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.067 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2E	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 01, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.098 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2U	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 18, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (1.138 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R39	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 33, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (0.919 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3R	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 51, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (0.979 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3J	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 43, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (1.077 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R40	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 60, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (1.069 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
6A2F	Crystal structure of biosynthetic alanine racemase from Pseudomonas aeruginosa 分子名称: ACETATE ION, Alanine racemase, biosynthetic, ... 著者 Dong, H, Li, S. 登録日 2018-06-11 公開日 2018-08-08 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Enzymatic characterization and crystal structure of biosynthetic alanine racemase from Pseudomonas aeruginosa PAO1. Biochem.Biophys.Res.Commun., 503, 2018
5R1Y	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry D10, DMSO-free 分子名称: 2-methyl-N-(4-methylphenyl)-L-alanine, Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (1.038 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2B	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry H03, DMSO-free 分子名称: Endothiapepsin, N-[(benzyloxy)carbonyl]-N-methyl-L-alanine 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (1.019 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2P	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 13, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (1.179 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R34	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 28, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (0.999 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R25	PanDDA analysis group deposition -- Endothiapepsin in complex with fragment F2X-Entry F08, DMSO-free 分子名称: 4-[(methylamino)methyl]phenol, ACETATE ION, Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (1.078 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R2L	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 09, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (0.999 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R31	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 25, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (0.92 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3H	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 41, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.039 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020
5R3W	PanDDA analysis group deposition -- Auto-refined data of Endothiapepsin for ground state model 56, DMSO-Free 分子名称: Endothiapepsin 著者 Wollenhaupt, J, Metz, A, Barthel, T, Lima, G.M.A, Heine, A, Mueller, U, Klebe, G, Weiss, M.S. 登録日 2020-02-13 公開日 2020-06-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.188 Å) 主引用文献 F2X-Universal and F2X-Entry: Structurally Diverse Compound Libraries for Crystallographic Fragment Screening. Structure, 28, 2020

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