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Crystal structure of a putative metal-dependent phosphoesterase (BAD_1165) from bifidobacterium adolescentis atcc 15703 at 1.94 A resolution
Descriptor:	1,2-ETHANEDIOL, ADENOSINE MONOPHOSPHATE, FE (III) ION, ...
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2010-07-19
Release date:	2010-08-25
Last modified:	2023-02-01
Method:	X-RAY DIFFRACTION (1.94 Å)
Cite:	Crystal structure of a metal-dependent phosphoesterase (YP_910028.1) from Bifidobacterium adolescentis: Computational prediction and experimental validation of phosphoesterase activity. Proteins, 79, 2011

5TCZ

NMR solution structure of engineered Protoxin-II analog
Descriptor:	Beta/omega-theraphotoxin-Tp2a
Authors:	Gibbs, A.C, Wickenden, A.D.
Deposit date:	2016-09-16
Release date:	2017-01-18
Method:	SOLUTION NMR
Cite:	Insensitivity to pain induced by a potent selective closed-state Nav1.7 inhibitor. Sci Rep, 7, 2017

4DOE

The liganded structure of Cbescii CelA GH9 module
Descriptor:	1,2-ETHANEDIOL, 1,4-DIETHYLENE DIOXIDE, 1,4-beta-glucanase, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2012-02-09
Release date:	2013-02-20
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (1.561 Å)
Cite:	Revealing nature's cellulase diversity: the digestion mechanism of Caldicellulosiruptor bescii CelA. Science, 342, 2013

4EL8

The unliganded structure of C.bescii CelA GH48 module
Descriptor:	1,2-ETHANEDIOL, CALCIUM ION, Glycoside hydrolase family 48, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2012-04-10
Release date:	2013-03-20
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (2.45 Å)
Cite:	Revealing nature's cellulase diversity: the digestion mechanism of Caldicellulosiruptor bescii CelA. Science, 342, 2013

3NL9

Crystal structure of a putative NTP pyrophosphohydrolase (Exig_1061) from EXIGUOBACTERIUM SP. 255-15 at 1.78 A resolution
Descriptor:	1,2-ETHANEDIOL, putative NTP pyrophosphohydrolase
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2010-06-21
Release date:	2010-07-21
Last modified:	2024-10-09
Method:	X-RAY DIFFRACTION (1.78 Å)
Cite:	Structure of a putative NTP pyrophosphohydrolase: YP_001813558.1 from Exiguobacterium sibiricum 255-15. Acta Crystallogr.,Sect.F, 66, 2010

3PDG

Structures of Clostridium thermocellum CbhA fibronectin(III)-like modules
Descriptor:	Fibronectin(III)-like module, SODIUM ION
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2010-10-22
Release date:	2011-11-23
Last modified:	2024-02-21
Method:	X-RAY DIFFRACTION (1.78 Å)
Cite:	Structure and function of the Clostridium thermocellum cellobiohydrolase A X1-module repeat: enhancement through stabilization of the CbhA complex. Acta Crystallogr.,Sect.D, 68, 2012

3PE9

Structures of Clostridium thermocellum CbhA fibronectin(III)-like modules
Descriptor:	Fibronectin(III)-like module, IODIDE ION
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2010-10-25
Release date:	2011-11-23
Last modified:	2024-02-21
Method:	X-RAY DIFFRACTION (1.69 Å)
Cite:	Structure and function of the Clostridium thermocellum cellobiohydrolase A X1-module repeat: enhancement through stabilization of the CbhA complex. Acta Crystallogr.,Sect.D, 68, 2012

3PDD

Structures of Clostridium thermocellum CbhA fibronectin(III)-like modules
Descriptor:	CALCIUM ION, CHLORIDE ION, Glycoside hydrolase, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2010-10-22
Release date:	2011-11-23
Last modified:	2024-02-21
Method:	X-RAY DIFFRACTION (1.72 Å)
Cite:	Structure and function of the Clostridium thermocellum cellobiohydrolase A X1-module repeat: enhancement through stabilization of the CbhA complex. Acta Crystallogr.,Sect.D, 68, 2012

4DOD

The structure of Cbescii CelA GH9 module
Descriptor:	1,2-ETHANEDIOL, 1,4-DIETHYLENE DIOXIDE, 1,4-beta-glucanase, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2012-02-09
Release date:	2013-02-20
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Revealing nature's cellulase diversity: the digestion mechanism of Caldicellulosiruptor bescii CelA. Science, 342, 2013

4FMT

Crystal structure of a ChpT protein (CC_3470) from Caulobacter crescentus CB15 at 2.30 A resolution
Descriptor:	ChpT protein, GLYCEROL, SODIUM ION
Authors:	Joint Center for Structural Genomics (JCSG), Shapiro, L.
Deposit date:	2012-06-18
Release date:	2012-07-25
Last modified:	2024-05-22
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Branched signal wiring of an essential bacterial cell-cycle phosphotransfer protein. Structure, 21, 2013

1ZKG

Crystal structure of Transcriptional regulator, TETR family (tm1030) from Thermotoga maritima at 2.30 A resolution
Descriptor:	UNKNOWN LIGAND, transcriptional regulator, TetR family
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2005-05-02
Release date:	2005-07-26
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Crystal structure of TM1030 from Thermotoga maritima at 2.3 A resolution reveals molecular details of its transcription repressor function. Proteins, 68, 2007

1ZX8

CRYSTAL STRUCTURE OF an atypical cyclophilin (peptidylprolyl cis-trans isomerase) (TM1367) FROM THERMOTOGA MARITIMA AT 1.90 A RESOLUTION
Descriptor:	NICKEL (II) ION, PENTAETHYLENE GLYCOL, hypothetical protein TM1367
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2005-06-07
Release date:	2005-07-26
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Crystal structure of TM1367 from Thermotoga maritima at 1.90 A resolution reveals an atypical member of the cyclophilin (peptidylprolyl isomerase) fold. Proteins, 63, 2006

1Z9F

Crystal structure of single stranded DNA-binding protein (TM0604) from Thermotoga maritima at 2.60 A resolution
Descriptor:	Single-strand binding protein
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2005-04-01
Release date:	2005-04-12
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Crystal structure of a single-stranded DNA-binding protein (TM0604) from Thermotoga maritima at 2.60 A resolution. Proteins, 63, 2006

2B8N

Crystal structure of Glycerate kinase (EC 2.7.1.31) (tm1585) from THERMOTOGA MARITIMA at 2.70 A resolution
Descriptor:	glycerate kinase, putative
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2005-10-07
Release date:	2005-11-08
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (2.53 Å)
Cite:	Crystal structure of a glycerate kinase (TM1585) from Thermotoga maritima at 2.70 A resolution reveals a new fold Proteins, 65, 2006

1ZCZ

Crystal structure of Phosphoribosylaminoimidazolecarboxamide formyltransferase / IMP cyclohydrolase (TM1249) from THERMOTOGA MARITIMA at 1.88 A resolution
Descriptor:	Bifunctional purine biosynthesis protein purH, POTASSIUM ION, TETRAETHYLENE GLYCOL
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2005-04-13
Release date:	2005-04-26
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.88 Å)
Cite:	Crystal structure of AICAR transformylase IMP cyclohydrolase (TM1249) from Thermotoga maritima at 1.88 A resolution. Proteins, 71, 2008

8YRH

Complex of SARS-CoV-2 main protease and Rosmarinic acid
Descriptor:	(2R)-3-(3,4-dihydroxyphenyl)-2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}propanoic acid, 3C-like proteinase nsp5
Authors:	Wang, Q.S, Li, Q.H.
Deposit date:	2024-03-21
Release date:	2024-07-03
Method:	X-RAY DIFFRACTION (1.841 Å)
Cite:	Structural basis of rosmarinic acid inhibitory mechanism on SARS-CoV-2 main protease. Biochem.Biophys.Res.Commun., 724, 2024

5CVY

The Structure of Bacillus pumilus GH48 in complex with cellobiose and cellohexaose
Descriptor:	1,2-ETHANEDIOL, CALCIUM ION, GLYCEROL, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2015-07-27
Release date:	2016-08-10
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Natural diversity of glycoside hydrolase family 48 exoglucanases: insights from structure. Biotechnol Biofuels, 10, 2017

5BV9

The Structure of Bacillus pumilus GH48 in complex with cellobiose
Descriptor:	1,2-ETHANEDIOL, ACETATE ION, CALCIUM ION, ...
Authors:	Alahuhta, P.M, Lunin, V.V.
Deposit date:	2015-06-04
Release date:	2015-09-30
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (1.93 Å)
Cite:	Strategies to reduce end-product inhibition in family 48 glycoside hydrolases. Proteins, 84, 2016

5E83

CRYSTAL STRUCTURE OF CARBONMONOXY HEMOGLOBIN S (LIGANDED SICKLE CELL HEMOGLOBIN) COMPLEXED WITH GBT440, CO-CRYSTALLIZATION EXPERIMENT
Descriptor:	2-methyl-3-({2-[1-(propan-2-yl)-1H-pyrazol-5-yl]pyridin-3-yl}methoxy)phenol, CARBON MONOXIDE, GLYCEROL, ...
Authors:	Patskovska, L, Patskovsky, Y, Bonanno, J.B, Almo, S.C.
Deposit date:	2015-10-13
Release date:	2016-07-20
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	GBT440 increases haemoglobin oxygen affinity, reduces sickling and prolongs RBC half-life in a murine model of sickle cell disease. Br.J.Haematol., 175, 2016

2IAY

Crystal structure of a duf1831 family protein (lp2179) from lactobacillus plantarum at 1.20 A resolution
Descriptor:	CHLORIDE ION, GLYCEROL, Hypothetical protein
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2006-09-08
Release date:	2006-10-10
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (1.2 Å)
Cite:	Structure of LP2179, the first representative of Pfam family PF08866, suggests a new fold with a role in amino-acid metabolism. Acta Crystallogr.,Sect.F, 66, 2010

2ICH

CRYSTAL STRUCTURE OF A PUTATIVE ATTH (NE1406) FROM NITROSOMONAS EUROPAEA AT 2.00 A RESOLUTION
Descriptor:	2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, GLYCEROL, Putative AttH, ...
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2006-09-12
Release date:	2006-10-03
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Structure of the first representative of Pfam family PF09410 (DUF2006) reveals a structural signature of the calycin superfamily that suggests a role in lipid metabolism. Acta Crystallogr.,Sect.F, 66, 2010

2IIZ

Crystal structure of putative melanin biosynthesis protein TyrA with bound heme (NP_716371.1) from Shewanella Oneidensis at 2.30 A resolution
Descriptor:	1,2-ETHANEDIOL, ISOPROPYL ALCOHOL, Melanin biosynthesis protein TyrA, ...
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2006-09-28
Release date:	2006-11-14
Last modified:	2023-11-15
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Identification and structural characterization of heme binding in a novel dye-decolorizing peroxidase, TyrA. Proteins, 69, 2007

2OOK

Crystal structure of a protein with unknown function (YP_749275.1) from Shewanella Frigidimarina NCIMB 400 at 1.80 A resolution
Descriptor:	1,2-ETHANEDIOL, Hypothetical protein
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2007-01-25
Release date:	2007-02-06
Last modified:	2023-01-25
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Open and closed conformations of two SpoIIAA-like proteins (YP_749275.1 and YP_001095227.1) provide insights into membrane association and ligand binding. Acta Crystallogr.,Sect.F, 66, 2010

3DUE

CRYSTAL STRUCTURE OF A PUTATIVE PERIPLASMIC PROTEIN FROM DUF2874 FAMILY (BVU_2987) FROM BACTEROIDES VULGATUS ATCC 8482 AT 1.85 A RESOLUTION
Descriptor:	CACODYLATE ION, Putative periplasmic protein
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2008-07-17
Release date:	2008-08-05
Last modified:	2024-10-09
Method:	X-RAY DIFFRACTION (1.85 Å)
Cite:	The structure of BVU2987 from Bacteroides vulgatus reveals a superfamily of bacterial periplasmic proteins with possible inhibitory function. Acta Crystallogr.,Sect.F, 66, 2010

3G0T

Crystal structure of putative aspartate aminotransferase (NP_905498.1) from Porphyromonas gingivalis W83 at 1.75 A resolution
Descriptor:	1,2-ETHANEDIOL, 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, CHLORIDE ION, ...
Authors:	Joint Center for Structural Genomics (JCSG)
Deposit date:	2009-01-28
Release date:	2009-02-10
Last modified:	2023-02-01
Method:	X-RAY DIFFRACTION (1.75 Å)
Cite:	Molecular characterization of novel pyridoxal-5'-phosphate-dependent enzymes from the human microbiome. Protein Sci., 23, 2014

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