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Cryo-EM structure of yeast mitochondrial RNA polymerase transcription initiation complex
Descriptor:	Chains: N, Chains: T, DNA-directed RNA polymerase, ...
Authors:	Das, K, Patel, S.S.
Deposit date:	2020-04-10
Release date:	2020-12-09
Last modified:	2023-10-18
Method:	ELECTRON MICROSCOPY (3.71 Å)
Cite:	Cryo-EM Structures Reveal Transcription Initiation Steps by Yeast Mitochondrial RNA Polymerase. Mol.Cell, 81, 2021

6NTX

Respiratory syncytial virus fusion protein N-terminal heptad repeat domain+VIQKI
Descriptor:	Fusion glycoprotein F0
Authors:	Outlaw, V.K, Kreitler, D.F, Gellman, S.H.
Deposit date:	2019-01-30
Release date:	2019-07-17
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Dual Inhibition of Human Parainfluenza Type 3 and Respiratory Syncytial Virus Infectivity with a Single Agent. J.Am.Chem.Soc., 141, 2019

6NRO

Human parainfluenza virus type 3 fusion protein N-terminal heptad repeat domain+VIQKI
Descriptor:	CALCIUM ION, DI(HYDROXYETHYL)ETHER, Human parainfluenza virus type 3 fusion glycoprotein C-terminal heptad repeat domain, ...
Authors:	Outlaw, V.K, Kreitler, D.F, Gellman, S.H.
Deposit date:	2019-01-23
Release date:	2019-07-17
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (1.75 Å)
Cite:	Dual Inhibition of Human Parainfluenza Type 3 and Respiratory Syncytial Virus Infectivity with a Single Agent. J.Am.Chem.Soc., 141, 2019

8F71

Crystal structure of the histidine kinase domain of bacteriophytochrome RpBphP2
Descriptor:	ADENOSINE-5'-TRIPHOSPHATE, Histidine kinase, MAGNESIUM ION
Authors:	Yang, X, Kumarapperuma, I, Tom, I.
Deposit date:	2022-11-17
Release date:	2023-11-22
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (3.19 Å)
Cite:	Mode of autophosphorylation in bacteriophytochromes RpBphP2 and RpBphP3. Photochem Photobiol Sci, 22, 2023

6NYX

Human parainfluenza virus type 3 fusion protein N-terminal heptad repeat domain+VI
Descriptor:	DI(HYDROXYETHYL)ETHER, Fusion glycoprotein F0, TETRAETHYLENE GLYCOL
Authors:	Outlaw, V.K, Kreitler, D.F, Gellman, S.H.
Deposit date:	2019-02-12
Release date:	2019-07-17
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (1.85 Å)
Cite:	Dual Inhibition of Human Parainfluenza Type 3 and Respiratory Syncytial Virus Infectivity with a Single Agent. J.Am.Chem.Soc., 141, 2019

6Z4K

A4V mutant of human SOD1 bound with benzyl benzoisoselenazolone derivative 6 in P21 space group
Descriptor:	CHLORIDE ION, Superoxide dismutase [Cu-Zn], ZINC ION, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.45 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4J

A4V mutant of human SOD1 bound with benzyl benzoisoselenazolone derivative 5 in P21 space group
Descriptor:	CHLORIDE ION, Superoxide dismutase [Cu-Zn], ZINC ION, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.55 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4M

A4V mutant of human SOD1 bound with 2-(pyridin-3-ylmethyl)benzoisoselenazolone derivative 10 in P21 space group
Descriptor:	CHLORIDE ION, SULFATE ION, Superoxide dismutase [Cu-Zn], ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.55 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4H

A4V mutant of human SOD1 bound with benzyl benzoisoselenazolone derivative 2 in P21 space group
Descriptor:	SULFATE ION, Superoxide dismutase [Cu-Zn], ZINC ION, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.95 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4L

A4V mutant of human SOD1 bound with 2-(pyridin-3-ylmethyl)benzoisoselenazolone derivative 9 in P21 space group
Descriptor:	SULFATE ION, Superoxide dismutase [Cu-Zn], ZINC ION, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4G

A4V mutant of human SOD1 bound with ebselen in P21 space group
Descriptor:	ACETATE ION, CHLORIDE ION, N-phenyl-2-selanylbenzamide, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (1.45 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

4IIE

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with calystegine B(2)
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2020-07-29
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

4IIF

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with castanospermine
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2020-07-29
Method:	X-RAY DIFFRACTION (2.45 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

6Z3V

A4V mutant of human SOD1 bound with N-aryl benzoisoselenazolone derivative 13 in P21 space group
Descriptor:	5-fluoranyl-~{N}-(3-morpholin-4-ylcarbonylphenyl)-2-selanyl-benzamide, SULFATE ION, Superoxide dismutase [Cu-Zn], ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-22
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.25 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4I

A4V mutant of human SOD1 bound with benzyl benzoisoselenazolone derivative 3 in P21 space group
Descriptor:	ACETATE ION, SULFATE ION, Superoxide dismutase [Cu-Zn], ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

6Z4O

A4V mutant of human SOD1 bound with benzyl benzoisoselenazolone derivative 1 in P21 space group
Descriptor:	SULFATE ION, Superoxide dismutase [Cu-Zn], ZINC ION, ...
Authors:	Amporndanai, K, Hasnain, S.S.
Deposit date:	2020-05-25
Release date:	2020-09-16
Last modified:	2024-01-24
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Novel Selenium-based compounds with therapeutic potential for SOD1-linked amyotrophic lateral sclerosis. Ebiomedicine, 59, 2020

4IIH

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with thiocellobiose
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2020-07-29
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

4IIB

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

4IID

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with 1-deoxynojirimycin
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 1-DEOXYNOJIRIMYCIN, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

4IIG

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with D-glucose
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

2YUE

Solution structure of the NEUZ (NHR) domain in Neuralized from Drosophila melanogaster
Descriptor:	Protein neuralized
Authors:	He, F, Muto, Y, Inoue, M, Kigawa, T, Shirouzu, M, Tarada, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:	2007-04-06
Release date:	2007-10-09
Last modified:	2024-05-29
Method:	SOLUTION NMR
Cite:	Structural and functional characterization of the NHR1 domain of the Drosophila neuralized E3 ligase in the notch signaling pathway. J.Mol.Biol., 393, 2009

4IIC

Crystal structure of beta-glucosidase 1 from Aspergillus aculeatus in complex with isofagomine
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:	Suzuki, K, Sumitani, J, Kawaguchi, T, Fushinobu, S.
Deposit date:	2012-12-20
Release date:	2013-04-10
Last modified:	2020-07-29
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Crystal structures of glycoside hydrolase family 3 beta-glucosidase 1 from Aspergillus aculeatus Biochem.J., 452, 2013

2BNA

STRUCTURE OF A B-DNA DODECAMER AT 16 KELVIN
Descriptor:	DNA (5'-D(CPGPCPGPAPAPTPTPCPGPCPG)-3')
Authors:	Drew, H.R, Samson, S, Dickerson, R.E.
Deposit date:	1981-11-12
Release date:	1982-02-03
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (2.7 Å)
Cite:	Structure of a B-DNA dodecamer at 16 K. Proc.Natl.Acad.Sci.USA, 79, 1982

8P7G

Structural characterization of PHOX2B and its DNA interactions shed lights into the molecular basis of the + 7Ala variant pathogenicity in CCHS
Descriptor:	Paired mesoderm homeobox protein 2B
Authors:	Russo, L, Diana, D, Fattorusso, R.
Deposit date:	2023-05-30
Release date:	2024-05-15
Last modified:	2024-06-26
Method:	SOLUTION NMR
Cite:	Structural characterization of PHOX2B and its DNA interaction shed light on the molecular basis of the +7Ala variant pathogenicity in CCHS. Chem Sci, 15, 2024

8Q1Q

mouse Keap1 in complex with stapled peptide
Descriptor:	Kelch-like ECH-associated protein 1, SULFATE ION, Stapled peptide, ...
Authors:	Kack, H, Wissler, L.
Deposit date:	2023-08-01
Release date:	2023-10-25
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (1.378 Å)
Cite:	A cell-active cyclic peptide targeting the Nrf2/Keap1 protein-protein interaction. Chem Sci, 14, 2023

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