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Crystal structure of BacD, an L-amino acid dipeptide ligase from Bacillus subtilis
分子名称:	(2S)-3-[(S)-[(1R)-1-aminoethyl](phosphonooxy)phosphoryl]-2-benzylpropanoic acid, ADENOSINE-5'-DIPHOSPHATE, Alanine-anticapsin ligase BacD, ...
著者	Shomura, Y, Higuchi, Y.
登録日	2011-12-14
公開日	2012-04-11
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Structural and enzymatic characterization of BacD, an l-amino acid dipeptide ligase from Bacillus subtilis Protein Sci., 2012

3VHW

Crystal structure of the human vitamin D receptor ligand binding domain complexed with 4-MP
分子名称:	Vitamin D3 receptor, methyl (1S,3E)-3-{(2R)-2-[(1R,3aS,4E,7aR)-4-{(2Z)-2-[(3R,4S,5R)-3,5-dihydroxy-4-(3-hydroxypropoxy)-2-methylidenecyclohexylidene]ethylidene}-7a-methyloctahydro-1H-inden-1-yl]propylidene}-1-ethyl-2-oxocyclopentanecarboxylate (non-preferred name)
著者	Kakuda, S, Takimoto-Kamimura, M.
登録日	2011-09-08
公開日	2013-03-06
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.43 Å)
主引用文献	Synthesis of novel C-2 substituted vitamin D derivatives having ringed side chains and their biological evaluation on bone J.Steroid Biochem.Mol.Biol., 136, 2013

4PPE

human RNF4 RING domain
分子名称:	E3 ubiquitin-protein ligase RNF4, ZINC ION
著者	Perry, J.J, Arvai, A.S, Hitomi, C, Tainer, J.A.
登録日	2014-02-26
公開日	2014-03-26
最終更新日	2024-02-28
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	RNF4 interacts with both SUMO and nucleosomes to promote the DNA damage response. Embo Rep., 15, 2014

7SL6

Full-length insulin receptor bound with site 2 binding deficient mutant insulin (B-L17R) -- symmetric conformation
分子名称:	Insulin A chain, Insulin B chain, Insulin receptor
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (3.7 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

7SL7

Full-length insulin receptor bound with both site 1 binding deficient mutant insulin (A-V3E) and site 2 binding deficient mutant insulin (A-L13R)
分子名称:	Insulin A chain (L13R), Insulin A chain (V3E), Insulin B chain, ...
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (3.1 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

7SL2

Full-length insulin receptor bound with site 2 binding deficient mutant insulin (A-L13R) -- asymmetric conformation
分子名称:	Insulin A chain, Insulin B chain, Insulin receptor
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (3.6 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

7SL3

Full-length insulin receptor bound with site 2 binding deficient mutant insulin (A-L13R) -- symmetric conformation
分子名称:	Insulin A chain, Insulin B chain, Insulin receptor
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (3.4 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

7SL4

Full-length insulin receptor bound with site 2 binding deficient mutant insulin (B-L17R) -- asymmetric conformation
分子名称:	Insulin A chain, Insulin B chain, Insulin receptor
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (5 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

7SL1

Full-length insulin receptor bound with site 1 binding deficient mutant insulin (A-V3E)
分子名称:	Insulin A chain, Insulin B chain, Insulin receptor
著者	Bai, X.C, Choi, E.
登録日	2021-10-22
公開日	2022-03-30
最終更新日	2022-04-27
実験手法	ELECTRON MICROSCOPY (3.4 Å)
主引用文献	Synergistic activation of the insulin receptor via two distinct sites. Nat.Struct.Mol.Biol., 29, 2022

2GRT

HUMAN GLUTATHIONE REDUCTASE A34E, R37W MUTANT, OXIDIZED GLUTATHIONE COMPLEX
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE, OXIDIZED GLUTATHIONE DISULFIDE
著者	Stoll, V.S, Simpson, S.J, Krauth-Siegel, R.L, Walsh, C.T, Pai, E.F.
登録日	1997-02-12
公開日	1997-08-12
最終更新日	2023-11-15
実験手法	X-RAY DIFFRACTION (2.7 Å)
主引用文献	Glutathione reductase turned into trypanothione reductase: structural analysis of an engineered change in substrate specificity. Biochemistry, 36, 1997

5WNE

X-RAY CO-STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE (ROCK1) WITH A HIGHLY SELECTIVE INHIBITOR
分子名称:	3,4-dimethoxy-N-({3-[(5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl}methyl)benzamide, GLYCEROL, Rho-associated protein kinase 1
著者	Li, X.
登録日	2017-07-31
公開日	2018-08-01
最終更新日	2024-03-13
実験手法	X-RAY DIFFRACTION (2.6 Å)
主引用文献	Novel mechanism of Rho kinase selectivity: beyond the ATP pocket To Be Published

5WNG

X-RAY CO-STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE (ROCK1) WITH A HIGHLY SELECTIVE INHIBITOR
分子名称:	(2R)-N-(3-cyanophenyl)-2-(3-{[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]carbamoyl}phenyl)pyrrolidine-1-carboxamide, Rho-associated protein kinase 1
著者	Li, X.
登録日	2017-07-31
公開日	2018-08-01
最終更新日	2024-03-13
実験手法	X-RAY DIFFRACTION (2.9 Å)
主引用文献	Novel mechanism of Rho kinase selectivity: beyond the ATP pocket To Be Published

5I20

Crystal structure of protein
分子名称:	(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, SULFATE ION, Uncharacterized protein
著者	Ishitani, R, Nureki, O.
登録日	2016-02-08
公開日	2016-06-01
最終更新日	2024-03-20
実験手法	X-RAY DIFFRACTION (2.4 Å)
主引用文献	Structural basis for amino acid export by DMT superfamily transporter YddG. Nature, 534, 2016

7S5H

PCSK9(deltaCRD) in complex with cyclic peptide 35
分子名称:	(2E)-but-2-ene-1,4-diol, Pro-peptide from Proprotein convertase subtilisin/kexin type 9, Proprotein convertase subtilisin/kexin type 9, ...
著者	Orth, P.
登録日	2021-09-10
公開日	2021-11-03
最終更新日	2024-04-24
実験手法	X-RAY DIFFRACTION (1.272 Å)
主引用文献	A Series of Novel, Highly Potent, and Orally Bioavailable Next-Generation Tricyclic Peptide PCSK9 Inhibitors. J.Med.Chem., 64, 2021

7S5G

PCSK9 in complex with compound 19
分子名称:	(2E)-but-2-ene-1,4-diol, GLYCEROL, Propeptide of Proprotein convertase subtilisin/kexin type 9, ...
著者	Orth, P.
登録日	2021-09-10
公開日	2021-11-03
最終更新日	2024-04-24
実験手法	X-RAY DIFFRACTION (2.041 Å)
主引用文献	A Series of Novel, Highly Potent, and Orally Bioavailable Next-Generation Tricyclic Peptide PCSK9 Inhibitors. J.Med.Chem., 64, 2021

1FMD

THE STRUCTURE AND ANTIGENICITY OF A TYPE C FOOT-AND-MOUTH DISEASE VIRUS
分子名称:	FOOT-AND-MOUTH DISEASE VIRUS (SUBUNIT VP1), FOOT-AND-MOUTH DISEASE VIRUS (SUBUNIT VP2), FOOT-AND-MOUTH DISEASE VIRUS (SUBUNIT VP3), ...
著者	Lea, S, Fry, E, Stuart, D.
登録日	1994-02-10
公開日	1994-08-31
最終更新日	2024-02-07
実験手法	X-RAY DIFFRACTION (3.5 Å)
主引用文献	The structure and antigenicity of a type C foot-and-mouth disease virus. Structure, 2, 1994

6XXV

Crystal Structure of a computationally designed Immunogen S2_1.2 in complex with its elicited antibody C57
分子名称:	Antibody C57, Heavy Chain, Light Chain, ...
著者	Yang, C, Sesterhenn, F, Correia, B.E, Pojer, F.
登録日	2020-01-28
公開日	2020-04-22
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.20116425 Å)
主引用文献	De novo protein design enables the precise induction of RSV-neutralizing antibodies. Science, 368, 2020

1GRG

SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE, PHOSPHATE ION
著者	Karplus, P.A, Schulz, G.E.
登録日	1992-12-15
公開日	1994-01-31
最終更新日	2024-06-05
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution. J.Mol.Biol., 210, 1989

1GRB

SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者	Karplus, P.A, Schulz, G.E.
登録日	1992-12-15
公開日	1994-01-31
最終更新日	2024-02-07
実験手法	X-RAY DIFFRACTION (1.85 Å)
主引用文献	Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution. J.Mol.Biol., 210, 1989

1GRF

SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称:	ACETAMIDE, FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE, ...
著者	Karplus, P.A, Schulz, G.E.
登録日	1992-12-15
公開日	1994-01-31
最終更新日	2024-06-05
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution. J.Mol.Biol., 210, 1989

1GRE

SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE, GLUTATHIONE REDUCTASE, ...
著者	Karplus, P.A, Schulz, G.E.
登録日	1992-12-15
公開日	1994-01-31
最終更新日	2024-06-05
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution. J.Mol.Biol., 210, 1989

1GRA

SUBSTRATE BINDING AND CATALYSIS BY GLUTATHIONE REDUCTASE AS DERIVED FROM REFINED ENZYME: SUBSTRATE CRYSTAL STRUCTURES AT 2 ANGSTROMS RESOLUTION
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE, GLUTATHIONE REDUCTASE, ...
著者	Karplus, P.A, Schulz, G.E.
登録日	1992-12-15
公開日	1994-01-31
最終更新日	2024-06-05
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Substrate binding and catalysis by glutathione reductase as derived from refined enzyme: substrate crystal structures at 2 A resolution. J.Mol.Biol., 210, 1989

8FLV

Bruton's tyrosine kinase in complex with compound 34
分子名称:	2-(3,5-dichloroanilino)-1-{(3R)-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}ethan-1-one, DI(HYDROXYETHYL)ETHER, DIMETHYL SULFOXIDE, ...
著者	Metrick, C.M, Marcotte, D.J.
登録日	2022-12-22
公開日	2023-04-05
最終更新日	2024-05-22
実験手法	X-RAY DIFFRACTION (1.3 Å)
主引用文献	Discovery of structural diverse reversible BTK inhibitors utilized to develop a novel in vivo CD69 and CD86 PK/PD mouse model. Bioorg.Med.Chem.Lett., 80, 2023

5B5K

Crystal structure of Izumo1, the mammalian sperm ligand for egg Juno
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Izumo sperm-egg fusion protein 1
著者	Nishimura, K, Han, L, De Sanctis, D, Jovine, L.
登録日	2016-05-11
公開日	2016-07-06
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	The structure of sperm Izumo1 reveals unexpected similarities with Plasmodium invasion proteins. Curr.Biol., 26, 2016

1GRT

HUMAN GLUTATHIONE REDUCTASE A34E/R37W MUTANT
分子名称:	FLAVIN-ADENINE DINUCLEOTIDE, GLUTATHIONE REDUCTASE
著者	Stoll, V.S, Simpson, S.J, Krauth-Siegel, R.L, Walsh, C.T, Pai, E.F.
登録日	1996-12-17
公開日	1997-06-16
最終更新日	2023-08-09
実験手法	X-RAY DIFFRACTION (2.3 Å)
主引用文献	Glutathione reductase turned into trypanothione reductase: structural analysis of an engineered change in substrate specificity. Biochemistry, 36, 1997

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