Search by PDB author - 日本蛋白質構造データバンク

English 日本語简体中文繁體中文 한국어

✖

ﾒﾆｭｰ

RCSB PDB PDBe BMRB Adv. Search Search help

Search by PDB author

Visualize

BU of 4l93 by Molmil

Crystal structure of Human Hsp90 with S36
分子名称:	3,4-dihydroisoquinolin-2(1H)-yl[2,4-dihydroxy-5-(propan-2-yl)phenyl]methanone, Heat shock protein HSP 90-alpha
著者	Li, J, Ren, J, Yang, M, Xiong, B, He, J.
登録日	2013-06-18
公開日	2014-06-18
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.845 Å)
主引用文献	Crystal structure of Human Hsp90 with S36 To be Published

Visualize

BU of 4l90 by Molmil

Crystal structure of Human Hsp90 with RL3
分子名称:	Heat shock protein HSP 90-alpha, [5-(6-bromo[1,2,4]triazolo[4,3-a]pyridin-3-yl)-2,4-dihydroxyphenyl](4-methylpiperazin-1-yl)methanone
著者	Li, J, Ren, J, Yang, M, Xiong, B, He, J.
登録日	2013-06-18
公開日	2014-06-18
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.001 Å)
主引用文献	Crystal structure of Human Hsp90 with RL3 to be published

Visualize

BU of 4lwf by Molmil

Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ3
分子名称:	4-(5-amino-1,2-oxazol-3-yl)-6-(propan-2-yl)benzene-1,3-diol, Heat shock protein HSP 90-alpha
著者	Li, J, Shi, F, Xiong, B, He, J.
登録日	2013-07-27
公開日	2014-07-30
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.75 Å)
主引用文献	Discovery of potent N-(isoxazol-5-yl)amides as HSP90 inhibitors. Eur.J.Med.Chem., 87, 2014

Visualize

BU of 4lwi by Molmil

Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ6
分子名称:	Heat shock protein HSP 90-alpha, N-{3-[2,4-dihydroxy-5-(propan-2-yl)phenyl]-4-(4-methoxyphenyl)-1,2-oxazol-5-yl}cyclopropanecarboxamide
著者	Li, J, Shi, F, Xiong, B, He, J.
登録日	2013-07-27
公開日	2014-07-30
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.7 Å)
主引用文献	Discovery of potent N-(isoxazol-5-yl)amides as HSP90 inhibitors. Eur.J.Med.Chem., 87, 2014

Visualize

BU of 7dno by Molmil

Characterization of Peptide Ligands Against WDR5 Isolated Using Phage Display Technique
分子名称:	CYS-ARG-THR-LEU-PRO-PHE, WD repeat-containing protein 5
著者	Cao, J, Cao, D, Xiong, B, Li, Y, Fan, T.
登録日	2020-12-10
公開日	2021-02-10
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (2.03 Å)
主引用文献	Phage-Display Based Discovery and Characterization of Peptide Ligands against WDR5. Molecules, 26, 2021

Visualize

BU of 7fai by Molmil

CARM1 bound with compound 9
分子名称:	Histone-arginine methyltransferase CARM1, N'-[[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(oxan-4-ylamino)pyrimidin-2-yl]phenyl]methyl]-N-methyl-ethane-1,2-diamine
著者	Cao, D.Y, Li, J, Xiong, B.
登録日	2021-07-06
公開日	2021-11-24
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (2.09749269 Å)
主引用文献	Structure-Based Discovery of Potent CARM1 Inhibitors for Solid Tumor and Cancer Immunology Therapy. J.Med.Chem., 64, 2021

Visualize

BU of 8ibq by Molmil

Bromodomain and Extra-terminal Domain (BET) BRD4
分子名称:	7-[2-fluoranyl-3-(1,3,5-trimethylpyrazol-4-yl)phenyl]-1~{H}-imidazo[4,5-b]pyridine, Bromodomain-containing protein 4
著者	Cao, D, Zhiyan, D, Xiong, B.
登録日	2023-02-10
公開日	2023-10-04
実験手法	X-RAY DIFFRACTION (1.45 Å)
主引用文献	Discovery of 1 H -Imidazo[4,5- b ]pyridine Derivatives as Potent and Selective BET Inhibitors for the Management of Neuropathic Pain. J.Med.Chem., 66, 2023

Visualize

BU of 8idh by Molmil

Bromodomain and Extra-terminal Domain (BET) BRD4
分子名称:	7-[2-fluoranyl-3-(1,3,5-trimethylpyrazol-4-yl)phenyl]-1~{H}-imidazo[4,5-b]pyridine, Bromodomain-containing protein 4
著者	Cao, D, Zhiyan, D, Xiong, B.
登録日	2023-02-13
公開日	2023-10-04
実験手法	X-RAY DIFFRACTION (1.57 Å)
主引用文献	Discovery of 1 H -Imidazo[4,5- b ]pyridine Derivatives as Potent and Selective BET Inhibitors for the Management of Neuropathic Pain. J.Med.Chem., 66, 2023

Visualize

BU of 7vln by Molmil

NSD2-PWWP1 domain bound with an imidazol-5-yl benzonitrile compound
分子名称:	4-[5-[4-(aminomethyl)-2,6-dimethoxy-phenyl]-3-methyl-imidazol-4-yl]benzenecarbonitrile, Histone-lysine N-methyltransferase NSD2
著者	Cao, D.Y, Li, Y.L, Li, J, Xiong, B.
登録日	2021-10-05
公開日	2022-07-06
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (3.09 Å)
主引用文献	Structure-Based Discovery of a Series of NSD2-PWWP1 Inhibitors. J.Med.Chem., 65, 2022

Visualize

BU of 7x6t by Molmil

Discovery of Selective BRD4 BD1 Inhibitor Based on [1,2,4] triazolo [4,3-b] pyridazine Scaffold
分子名称:	(2~{R})-2-[[3-methyl-6-(2-phenoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]amino]propanamide, Isoform C of Bromodomain-containing protein 4
著者	Cao, D, Xiong, B.
登録日	2022-03-08
公開日	2023-03-22
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (1.44 Å)
主引用文献	Discovery of Selective BRD4 BD1 Inhibitor Based on [1,2,4] triazolo [4,3-b] pyridazine Scaffold To Be Published

Visualize

BU of 5xhy by Molmil

BRD4 bound with compound Bdi1
分子名称:	Bromodomain-containing protein 4, ~{N}-(4-cyclopropyl-1,3,3-trimethyl-2-oxidanylidene-quinoxalin-6-yl)-4-methyl-benzenesulfonamide
著者	Xiong, B, Cao, D, Li, Y.
登録日	2017-04-25
公開日	2018-05-02
最終更新日	2024-03-27
実験手法	X-RAY DIFFRACTION (1.976 Å)
主引用文献	BRD4 bound with compound Bdi1 To Be Published

Visualize

BU of 8wiu by Molmil

Bromodomain and Extra-terminal Domain (BET) BRD4
分子名称:	7-[5-[1-(cyclopropylmethyl)-3,5-dimethyl-pyrazol-4-yl]pyridin-3-yl]-1~{H}-imidazo[4,5-b]pyridine, Isoform C of Bromodomain-containing protein 4
著者	Cao, D, Zhiyan, D, Xiong, B.
登録日	2023-09-25
公開日	2024-01-03
実験手法	X-RAY DIFFRACTION (1.4 Å)
主引用文献	Discovery of a brain-permeable bromodomain and extra terminal domain (BET) inhibitor with selectivity for BD1 for the treatment of multiple sclerosis. Eur.J.Med.Chem., 265, 2023

Visualize

BU of 4i59 by Molmil

Cyclohexylamine Oxidase from Brevibacterium oxydans IH-35A complexed with cyclohexanone
分子名称:	CYCLOHEXANONE, Cyclohexylamine Oxidase, FLAVIN-ADENINE DINUCLEOTIDE
著者	Mirza, I.A, Berghuis, A.M.
登録日	2012-11-28
公開日	2013-05-01
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.93 Å)
主引用文献	Structural Analysis of a Novel Cyclohexylamine Oxidase from Brevibacterium oxydans IH-35A. Plos One, 8, 2013

Visualize

BU of 4i58 by Molmil

Cyclohexylamine Oxidase from Brevibacterium oxydans IH-35A
分子名称:	Cyclohexylamine Oxidase, FLAVIN-ADENINE DINUCLEOTIDE
著者	Mirza, I.A, Berghuis, A.M.
登録日	2012-11-28
公開日	2013-05-01
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (3 Å)
主引用文献	Structural Analysis of a Novel Cyclohexylamine Oxidase from Brevibacterium oxydans IH-35A. Plos One, 8, 2013

Visualize

BU of 5z0s by Molmil

Crystal structure of FGFR1 kinase domain in complex with a novel inhibitor
分子名称:	1-[(6-chloroimidazo[1,2-b]pyridazin-3-yl)sulfonyl]-6-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridine, Fibroblast growth factor receptor 1
著者	Liu, Q, Xu, Y.
登録日	2017-12-20
公開日	2018-12-26
最終更新日	2023-11-22
実験手法	X-RAY DIFFRACTION (2.45 Å)
主引用文献	Structure-Based Discovery of a Series of 5H-Pyrrolo[2,3-b]pyrazine FGFR Kinase Inhibitors Molecules, 23, 2018

Visualize

BU of 4ivt by Molmil

Crystal structure of BACE1 with its inhibitor
分子名称:	Beta-secretase 1, N-{N-[4-(acetylamino)-3,5-dichlorobenzyl]carbamimidoyl}-2-(1H-indol-1-yl)acetamide, SULFATE ION
著者	Chen, T.T, Li, L, Chen, W.Y, Xu, Y.C.
登録日	2013-01-23
公開日	2013-11-13
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.6 Å)
主引用文献	Virtual screening and structure-based discovery of indole acylguanidines as potent beta-secretase (BACE1) inhibitors Molecules, 18, 2013

Visualize

BU of 4ivs by Molmil

Crystal structure of BACE1 with its inhibitor
分子名称:	Beta-secretase 1, N-{N-[4-(acetylamino)-3,5-dichlorobenzyl]carbamimidoyl}-2-(6-cyano-1H-indol-1-yl)acetamide
著者	Chen, T.T, Li, L, Chen, W.Y, Xu, Y.C.
登録日	2013-01-23
公開日	2013-11-13
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.636 Å)
主引用文献	Virtual screening and structure-based discovery of indole acylguanidines as potent beta-secretase (BACE1) inhibitors Molecules, 18, 2013

Visualize

BU of 7c2q by Molmil

The crystal structure of COVID-19 main protease in the apo state
分子名称:	3C-like proteinase
著者	Zhou, X.L, Zhong, F.L, Lin, C, Hu, X.H, Zhou, H, Wang, Q.S, Li, j, Zhang, J.
登録日	2020-05-08
公開日	2020-09-02
最終更新日	2023-11-29
実験手法	X-RAY DIFFRACTION (1.93 Å)
主引用文献	Structure of SARS-CoV-2 main protease in the apo state. Sci China Life Sci, 64, 2021

221051

件を2024-06-12に公開中

PDB statistics

PDBj update info

Contact PDBj

numon