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Crystal structure of PASTA domains of the Penicillin-Binding Protein 1 (PBP1) from Staphylococcus aureus
分子名称:	CHLORIDE ION, Penicillin-binding protein 1
著者	Martinez Caballero, S, Hermoso, J.A.
登録日	2021-04-05
公開日	2021-11-03
最終更新日	2024-01-31
実験手法	X-RAY DIFFRACTION (1.51 Å)
主引用文献	Integrative structural biology of the penicillin-binding protein-1 from Staphylococcus aureus , an essential component of the divisome machinery. Comput Struct Biotechnol J, 19, 2021

7O4A

Crystal structure of Penicillin-Binding Protein 1 (PBP1) from Staphylococcus aureus in complex with piperacillin
分子名称:	Hydrolyzed piperacillin, Penicillin-binding protein 1
著者	Martinez Caballero, S, Hermoso, J.A.
登録日	2021-04-05
公開日	2021-11-03
最終更新日	2024-01-31
実験手法	X-RAY DIFFRACTION (3.028 Å)
主引用文献	Integrative structural biology of the penicillin-binding protein-1 from Staphylococcus aureus , an essential component of the divisome machinery. Comput Struct Biotechnol J, 19, 2021

7O49

Crystal structure of Penicillin-Binding Protein 1 (PBP1) from Staphylococcus aureus
分子名称:	4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CADMIUM ION, CHLORIDE ION, ...
著者	Martinez Caballero, S, Hermoso, J.A.
登録日	2021-04-05
公開日	2021-11-03
最終更新日	2024-01-31
実験手法	X-RAY DIFFRACTION (3.03 Å)
主引用文献	Integrative structural biology of the penicillin-binding protein-1 from Staphylococcus aureus , an essential component of the divisome machinery. Comput Struct Biotechnol J, 19, 2021

8BRE

1,6-anhydro-n-actetylmuramic acid kinase (AnmK)
分子名称:	Anhydro-N-acetylmuramic acid kinase, CHLORIDE ION
著者	Jimenez-Faraco, E, Hermoso, J.A.
登録日	2022-11-23
公開日	2023-09-20
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Catalytic process of anhydro-N-acetylmuramic acid kinase from Pseudomonas aeruginosa. J.Biol.Chem., 299, 2023

8CPB

1,6-anhydro-n-actetylmuramic acid kinase (AnmK) in complex with AMPPNP, and AnhMurNAc at 1.7 Angstroms resolution.
分子名称:	2-(2-ACETYLAMINO-4-HYDROXY-6,8-DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-PROPIONIC ACID, Anhydro-N-acetylmuramic acid kinase, GLYCEROL, ...
著者	Jimenez-Faraco, E, Hermoso, J.A.
登録日	2023-03-02
公開日	2023-09-20
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (1.7 Å)
主引用文献	Catalytic process of anhydro-N-acetylmuramic acid kinase from Pseudomonas aeruginosa. J.Biol.Chem., 299, 2023

4UPD

Open conformation of O. piceae sterol esterase mutant I544W
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose, STEROL ESTERASE, TRIETHYLENE GLYCOL, ...
著者	Gutierrez-Fernandez, J, Vaquero, M.E, Prieto, A, Barriuso, J, Gonzalez, M.J, Hermoso, J.A.
登録日	2014-06-16
公開日	2014-09-24
最終更新日	2024-01-10
実験手法	X-RAY DIFFRACTION (2.4 Å)
主引用文献	Crystal Structures of Ophiostoma Piceae Sterol Esterase: Structural Insights Into Activation Mechanism and Product Release. J.Struct.Biol., 187, 2014

2IXV

Crystal structure of the modular Cpl-1 endolysin complexed with a peptidoglycan analogue (E94Q mutant)
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-N-acetyl-alpha-muramic acid, ALANINE, D-GLUTAMINE, ...
著者	Perez-Dorado, I, Hermoso, J.A.
登録日	2006-07-11
公開日	2007-07-03
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.96 Å)
主引用文献	Elucidation of the Molecular Recognition of Bacterial Cell Wall by Modular Pneumococcal Phage Endolysin Cpl-1. J.Biol.Chem., 282, 2007

2J8G

Crystal structure of the modular Cpl-1 endolysin complexed with a peptidoglycan analogue (E94Q mutant in complex with a tetrasaccharide- pentapeptide)
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-N-acetyl-beta-muramic acid-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ALANINE, D-GLUTAMIC ACID, ...
著者	Perez-Dorado, I, Hermoso, J.A.
登録日	2006-10-25
公開日	2007-07-03
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.69 Å)
主引用文献	Elucidation of the Molecular Recognition of Bacterial Cell Wall by Modular Pneumococcal Phage Endolysin Cpl-1. J.Biol.Chem., 282, 2007

2J8F

Crystal structure of the modular Cpl-1 endolysin complexed with a peptidoglycan analogue (E94Q mutant in complex with a disaccharide- pentapeptide)
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-methyl 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-beta-D-glucopyranoside, ALANINE, D-GLUTAMIC ACID, ...
著者	Perez-Dorado, I, Hermoso, J.A.
登録日	2006-10-25
公開日	2007-07-03
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (1.84 Å)
主引用文献	Elucidation of the Molecular Recognition of Bacterial Cell Wall by Modular Pneumococcal Phage Endolysin Cpl-1. J.Biol.Chem., 282, 2007

2IXU

Crystal structure of the modular Cpl-1 endolysin complexed with a peptidoglycan analogue (wild-type endolysin)
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-N-acetyl-alpha-muramic acid, ALANINE, D-alpha-glutamine, ...
著者	Perez-Dorado, I, Hermoso, J.A.
登録日	2006-07-11
公開日	2007-07-03
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (2.28 Å)
主引用文献	Elucidation of the Molecular Recognition of Bacterial Cell Wall by Modular Pneumococcal Phage Endolysin Cpl-1. J.Biol.Chem., 282, 2007

1W52

Crystal structure of a proteolyzed form of pancreatic lipase related protein 2 from horse
分子名称:	CALCIUM ION, DECYLAMINE-N,N-DIMETHYL-N-OXIDE, PANCREATIC LIPASE RELATED PROTEIN 2
著者	Mancheno, J.M, Jayne, S, Kerfelec, B, Chapus, C, Crenon, I, Hermoso, J.A.
登録日	2004-08-04
公開日	2006-07-12
最終更新日	2023-12-13
実験手法	X-RAY DIFFRACTION (2.99 Å)
主引用文献	Crystalization of a Proteolyzed Form of the Horse Pancreatic Lipase-Related Protein 2: Structural Basis for the Specific Detergent Requirement. Acta Crystallogr.,Sect.D, 60, 2004

7O4B

Crystal structure of Penicillin-Binding Protein 1 (PBP1) from Staphylococcus aureus in complex with penicillin G
分子名称:	CITRIC ACID, OPEN FORM - PENICILLIN G, Penicillin-binding protein 1, ...
著者	Martinez Caballero, S, Hermoso, J.A.
登録日	2021-04-05
公開日	2021-11-03
最終更新日	2024-01-31
実験手法	X-RAY DIFFRACTION (2.593 Å)
主引用文献	Integrative structural biology of the penicillin-binding protein-1 from Staphylococcus aureus , an essential component of the divisome machinery. Comput Struct Biotechnol J, 19, 2021

7OK9

Crystal structure of Penicillin-Binding Protein 1 (PBP1) from Staphylococcus aureus in complex with pentaglycine
分子名称:	CADMIUM ION, CHLORIDE ION, Penicillin-binding protein 1, ...
著者	Martinez Caballero, S, Hermoso, J.A.
登録日	2021-05-17
公開日	2021-11-03
最終更新日	2024-01-31
実験手法	X-RAY DIFFRACTION (3.36 Å)
主引用文献	Integrative structural biology of the penicillin-binding protein-1 from Staphylococcus aureus , an essential component of the divisome machinery. Comput Struct Biotechnol J, 19, 2021

8C0U

1,6-anhydro-n-actetylmuramic acid kinase (AnmK) in complex with their natural substrates and products
分子名称:	(2~{R})-2-[(2~{S},3~{R},4~{R},5~{S},6~{R})-3-acetamido-2,5-bis(oxidanyl)-6-(phosphonooxymethyl)oxan-4-yl]oxypropanoic acid, 2-(2-ACETYLAMINO-4-HYDROXY-6,8-DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-PROPIONIC ACID, ADENOSINE-5'-DIPHOSPHATE, ...
著者	Jimenez-Faraco, E, Hermoso, J.A.
登録日	2022-12-19
公開日	2023-09-20
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (2.112 Å)
主引用文献	Catalytic process of anhydro-N-acetylmuramic acid kinase from Pseudomonas aeruginosa. J.Biol.Chem., 299, 2023

8CP9

1,6-anhydro-n-actetylmuramic acid kinase (AnmK)in complex with non-hydrolyzable AMPPNP.
分子名称:	Anhydro-N-acetylmuramic acid kinase, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
著者	Jimenez-Faraco, E, Hermoso, J.A.
登録日	2023-03-02
公開日	2023-09-20
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (2.2 Å)
主引用文献	Catalytic process of anhydro-N-acetylmuramic acid kinase from Pseudomonas aeruginosa. J.Biol.Chem., 299, 2023

8A39

Crystal Structure of PaaX from Escherichia coli W
分子名称:	DNA-binding transcriptional repressor of phenylacetic acid degradation, aryl-CoA responsive, GLYCEROL, ...
著者	Molina, R, Alba-Perez, A, Hermoso, J.A.
登録日	2022-06-07
公開日	2023-07-05
最終更新日	2024-01-17
実験手法	X-RAY DIFFRACTION (2.3 Å)
主引用文献	Structural characterization of PaaX, the main repressor of the phenylacetate degradation pathway in Escherichia coli W: A novel fold of transcription regulator proteins. Int.J.Biol.Macromol., 254, 2024

8B58

Crystal Structure of Cyclophilin TgCyp23 from Toxoplasma gondii in complex with Cyclosporin A
分子名称:	Cyclosporin A, Peptidyl-prolyl cis-trans isomerase
著者	Jimenez-Faraco, E, Hermoso, J.A.
登録日	2022-09-22
公開日	2023-02-01
最終更新日	2023-02-22
実験手法	X-RAY DIFFRACTION (1.1 Å)
主引用文献	Structural Basis for Cyclosporin Isoform-Specific Inhibition of Cyclophilins from Toxoplasma gondii . Acs Infect Dis., 9, 2023

6R5V

The crystal structure of Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with xylotriose
分子名称:	DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, Periplasmic beta-glucosidase, ...
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5P

The crystal structure of Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with glucose
分子名称:	MAGNESIUM ION, Periplasmic beta-glucosidase, beta-D-glucopyranose
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.85 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5U

The crystal structure of Glycoside Hydrolase BglX inactive mutant from P. aeruginosa in complex with laminaritriose
分子名称:	MAGNESIUM ION, Periplasmic beta-glucosidase, beta-D-glucopyranose-(1-3)-beta-D-glucopyranose, ...
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.15 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5T

The crystal structure of Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with lactose
分子名称:	DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, Periplasmic beta-glucosidase, ...
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.6 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5N

The crystal structure of Glycoside Hydrolase BglX from P. aeruginosa in complex with 1-deoxynojirimycin
分子名称:	1-DEOXYNOJIRIMYCIN, MAGNESIUM ION, Periplasmic beta-glucosidase, ...
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5O

The crystal structure the Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with two glucose molecules
分子名称:	MAGNESIUM ION, Periplasmic beta-glucosidase, beta-D-glucopyranose
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.4 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5I

The crystal structure of the Glycoside Hydrolase BglX from P. aeruginosa
分子名称:	MAGNESIUM ION, Periplasmic beta-glucosidase, SULFATE ION
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

6R5R

The crystal structure of Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with cellobiose
分子名称:	DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, Periplasmic beta-glucosidase, ...
著者	Batuecas, M.T, Hermoso, J.A.
登録日	2019-03-25
公開日	2020-04-15
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (1.65 Å)
主引用文献	Catalytic Cycle of Glycoside Hydrolase BglX fromPseudomonas aeruginosaand Its Implications for Biofilm Formation. Acs Chem.Biol., 15, 2020

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