Mine: New entries

6KL0
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CRYSTAL STRUCTURE OF THE S65T/F99S/M153T/V163A VARIANT OF PERDEUTERATED GFP AT PD 7.0
Descriptor:Green fluorescent protein
Authors:Tai, Y., Takaba, K., Hanazono, Y., Miki, K., Takeda, K.
Deposit date:2019-07-28
Release date:2019-12-11
Method:X-RAY DIFFRACTION (0.798 Å)
Cite:X-ray crystallographic studies on the hydrogen isotope effects of green fluorescent protein at sub-angstrom resolutions
Acta Crystallogr.,Sect.D, 75, 2019
6KL1
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CRYSTAL STRUCTURE OF THE S65T/F99S/M153T/V163A VARIANT OF NON-DEUTERATED GFP AT PD 8.5
Descriptor:Green fluorescent protein
Authors:Tai, Y., Takaba, K., Hanazono, Y., Dao, H.A., Miki, K., Takeda, K.
Deposit date:2019-07-28
Release date:2019-12-11
Method:X-RAY DIFFRACTION (0.851 Å)
Cite:X-ray crystallographic studies on the hydrogen isotope effects of green fluorescent protein at sub-angstrom resolutions
Acta Crystallogr.,Sect.D, 75, 2019
6KKZ
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CRYSTAL STRUCTURE OF THE S65T/F99S/M153T/V163A VARIANT OF PERDEUTERATED GFP AT PD 8.5
Descriptor:Green fluorescent protein
Authors:Tai, Y., Takaba, K., Hanazono, Y., Dao, H.A., Miki, K., Takeda, K.
Deposit date:2019-07-28
Release date:2019-12-11
Method:X-RAY DIFFRACTION (0.9 Å)
Cite:X-ray crystallographic studies on the hydrogen isotope effects of green fluorescent protein at sub-angstrom resolutions
Acta Crystallogr.,Sect.D, 75, 2019
6S5W
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STRUCTURE OF RIB DOMAIN 'RIB LONG' FROM LACTOBACILLUS ACIDOPHILUS
Descriptor:Surface protein, SULFATE ION, SODIUM ION
Authors:Griffiths, S.C., Cooper, R.E.M., Whelan, F., Whittingham, J.L., Bateman, A., Potts, J.R.
Deposit date:2019-07-02
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.07 Å)
Cite:The Rib domain: Defining the remarkable structural malleability of a bacterial surface protein domain implicated in infection.
To Be Published
6Q1M
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CRYSTAL STRUCTURE OF THE WHEAT DWARF VIRUS REP DOMAIN
Descriptor:Replication-associated protein, GLYCEROL
Authors:Litzau, L.A., Everett, B.A., Evans III, R.L., Shi, K., Tompkins, K., Gordon, W.R.
Deposit date:2019-08-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.24 Å)
Cite:Crystal structure of the wheat dwarf virus Rep domain
Acta Crystallogr.,Sect.F, 75, 2019
6R2W
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CRYSTAL STRUCTURE OF THE SUPER-ACTIVE FVIIA VARIANT VYT IN COMPLEX WITH TISSUE FACTOR
Descriptor:Coagulation factor VII, Tissue factor, CALCIUM ION, ...
Authors:Sorensen, A.B., Svensson, L.A., Gandhi, P.S.
Deposit date:2019-03-19
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Beating soluble tissue factor at its own game - design and properties of a soluble tissue factor-independent coagulation factor VIIa
To Be Published
6SL9
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HIGH RESOLUTION APO STRUCTURE OF ISOMERASE PAAG
Descriptor:Enoyl-CoA hydratase/carnithine racemase, GLYCEROL
Authors:Saleem-Batcha, R., Spieker, M., Teufel, R.
Deposit date:2019-08-19
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.27 Å)
Cite:Structural and Mechanistic Basis of an Oxepin-CoA Forming Isomerase in Bacterial Primary and Secondary Metabolism.
Acs Chem.Biol., 2019
6IX1
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STRUCTURE OF 2S ALBUMIN SEED PROTEIN FROM DOLICHOS
Descriptor:2S Albumin protein, SULFATE ION
Authors:Sharma, S.C., Kumar, A., Salunke, D.M.
Deposit date:2018-12-08
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:Structure of 2S albumin from Dolichos
To Be Published
6UWP
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BACE-1 IN COMPLEX WITH COMPOUND #32
Descriptor:Beta-secretase 1, (1R,2R)-2-[(4aR,7aR)-2-amino-6-(pyrimidin-2-yl)-4a,5,6,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-7a(4H)-yl]-N-{[(1R,2R)-2-methylcyclopropyl]methyl}cyclopropane-1-carboxamide, GLYCEROL, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6JEE
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CRYSTAL STRUCTURE OF APO-L161C/L165C-FR
Descriptor:Ferritin light chain, CADMIUM ION, SULFATE ION, ...
Authors:Abe, S., Ito, N., Maity, B., Lu, C., Lu, D., Ueno, T.
Deposit date:2019-02-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Coordination design of cadmium ions at the 4-fold axis channel of the apo-ferritin cage.
Dalton Trans, 48, 2019
6UWV
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BACE-1 IN COMPLEX WITH COMPOUND #34
Descriptor:Beta-secretase 1, (4aR,7aR)-7a-[(1R,2R)-2-(2-{[(1R,2R)-2-methylcyclopropyl]methoxy}propan-2-yl)cyclopropyl]-6-(pyrimidin-2-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine, GLYCEROL, ...
Authors:Hendle, J., Stout, S.L.
Deposit date:2019-11-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6IX2
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STRUCTURE OF THE A214C/A250I MUTANT OF AN EPOXIDE HYDROLASE FROM ASPERGILLUS USAMII E001 (AUEH2) AT 1.48 ANGSTROMS RESOLUTION
Descriptor:Microsomal epoxide hyddrolase, GLYCEROL
Authors:Hu, D., Hu, B.C., Hou, X.D., Rao, Y.J., Wu, M.C.
Deposit date:2018-12-09
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.478 Å)
Cite:Structure of the A214C/A250I mutant of an epoxide hydrolase from Aspergillus usamii E001 (AuEH2) at 1.48 Angstroms resolution
To Be Published
6PGD
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WDR5DELTA32 BOUND TO PEPTIDOMIMETIC
Descriptor:WD repeat-containing protein 5, N-acetyl-L-alanyl-5-[5-(hydroxymethyl)-1H-imidazol-2-yl]-L-norvalyl-L-valinamide, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6Q92
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CRYSTAL STRUCTURE OF HUMAN ARGINASE-1 AT PH 7.0 IN COMPLEX WITH ABH
Descriptor:Arginase-1, MANGANESE (II) ION, 2(S)-AMINO-6-BORONOHEXANOIC ACID, ...
Authors:Grobben, Y., Uitdehaag, J.C.M., Zaman, G.J.R.
Deposit date:2018-12-17
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural insights into human Arginase-1 pH dependence and its inhibition by the small molecule inhibitor CB-1158
J.Struct.Biol., 2019
6SU3
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CRYSTAL STRUCTURE OF THE 48C12 HELIORHODOPSIN IN THE VIOLET FORM AT PH 8.8
Descriptor:48C12 heliorhodopsin, EICOSANE, (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, ...
Authors:Kovalev, K., Volkov, D., Astashkin, R., Alekseev, A., Gushchin, I., Gordeliy, V.
Deposit date:2019-09-12
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:High Resolution Structural Insights into Heliorhodopsin Family
To Be Published
6SU4
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CRYSTAL STRUCTURE OF THE 48C12 HELIORHODOPSIN IN THE BLUE FORM AT PH 4.3
Descriptor:48C12 heliorhodopsin, ACETATE ION, OLEIC ACID, ...
Authors:Kovalev, K., Volkov, D., Astashkin, R., Alekseev, A., Gushchin, I., Gordeliy, V.
Deposit date:2019-09-12
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:High Resolution Structural Insights into Heliorhodopsin Family
To Be Published
6IWK
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THE STRUCTURE OF MALTOOLIGOSACCHARIDE-FORMING AMYLASE FROM PSEUDOMONAS SACCHAROPHILA STB07
Descriptor:Glucan 1,4-alpha-maltotetraohydrolase, GLYCEROL, CALCIUM ION
Authors:Li, Z.F., Ban, X.F., Zhang, Z.Q., Li, C.M., Gu, Z.B., Jin, T.C., Li, Y.L., Shang, Y.H.
Deposit date:2018-12-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.501 Å)
Cite:Maltotetraose-forming amylase from Pseudomonas saccharophila STB07
To Be Published
6IX4
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STRUCTURE OF AN EPOXIDE HYDROLASE FROM ASPERGILLUS USAMII E001 (AUEH2) AT 1.51 ANGSTROMS RESOLUTION
Descriptor:Microsomal epoxide hydrolase, ACETATE ION, GLYCEROL, ...
Authors:Hu, D., Hu, B.C., Hou, X.D., Wu, L., Rao, Y.J., Wu, M.C.
Deposit date:2018-12-09
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.511 Å)
Cite:Structure of an epoxide hydrolase from Aspergillus usamii E001 (AuEH2) at 1.51 Angstroms resolution
To Be Published
6PGF
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WDR5DELTA32 BOUND TO N-(4-(4-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)ACRYLAMIDE
Descriptor:WD repeat-containing protein 5, N-{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}prop-2-enamide, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6NAC
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CRYSTAL STRUCTURE OF [FEFE]-HYDROGENASE I (CPI) SOLVED WITH SINGLE PULSE FREE ELECTRON LASER DATA
Descriptor:Iron hydrogenase 1, dicarbonyl[bis(cyanide-kappaC)]-mu-(iminodimethanethiolatato-1kappaS:2kappaS)-mu-(oxomethylidene)diiron(2+), IRON/SULFUR CLUSTER, ...
Authors:Cohen, A.E., Davidson, C.M., Zadvornyy, O.A., Keable, S.M., Lyubimov, A.Y., Song, J., McPhillips, S.E., Soltis, S.M., Peters, J.W.
Deposit date:2018-12-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Tuning catalytic bias of hydrogen gas producing hydrogenases
To Be Published
6OR0
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CRYSTAL STRUCTURE OF INSULIN FROM NON-MEROHEDRALLY TWINNED CRYSTALS
Descriptor:Insulin chain A, Insulin chain B
Authors:Sevvana, M., Ruf, M., Uson, I., Sheldrick, G.M., Herbst-Irmer, R.
Deposit date:2019-04-29
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Non-merohedral twinning: from minerals to proteins.
Acta Crystallogr D Struct Biol, 75, 2019
6P0C
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HUMAN DNA LIGASE 1 BOUND TO AN ADENYLATED, HYDROXYL TERMINATED DNA NICK IN EDTA
Descriptor:DNA ligase 1, DNA (5'-D(*GP*CP*TP*GP*AP*TP*GP*CP*GP*TP*C)-3'), DNA (5'-D(P*GP*TP*CP*GP*GP*AP*C)-3'), ...
Authors:Schellenberg, M.J., Tumbale, P.S., Riccio, A.A., Williams, R.S.
Deposit date:2019-05-16
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Two-tiered enforcement of high-fidelity DNA ligation.
Nat Commun, 10, 2019
6V1C
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CRYSTAL STRUCTURE OF HUMAN TREFOIL FACTOR 3 IN COMPLEX WITH ITS COGNATE LIGAND
Descriptor:Trefoil factor 3, N/A4-O-[2-(ACETYLAMINO)-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL]-BETA-D-GALACTOPYRANOSE
Authors:Jarva, M.A., Lingford, J.P., John, A., Scott, N.E., Goddard-Borger, E.D.
Deposit date:2019-11-20
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Trefoil factors share a lectin activity that defines their role in mucus
Biorxiv, 2019
6UVP
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BACE-1 IN COMPLEX WITH COMPOUND #3
Descriptor:Beta-secretase 1, N-{(1S,2S)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide, N-{(1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide, ...
Authors:Hendle, J., Timm, D.E.
Deposit date:2019-11-04
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Preparation and biological evaluation of BACE1 inhibitors: Leveraging trans-cyclopropyl moieties as ligand efficient conformational constraints.
Bioorg.Med.Chem., 2019
6JEF
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CRYSTAL STRUCTURE OF APO-R168C/L169C-FR
Descriptor:Ferritin light chain, SULFATE ION, CADMIUM ION, ...
Authors:Abe, S., Ito, N., Maity, B., Lu, C., Lu, D., Ueno, T.
Deposit date:2019-02-05
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Coordination design of cadmium ions at the 4-fold axis channel of the apo-ferritin cage.
Dalton Trans, 48, 2019