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6P6P
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CRYSTAL STRUCTURE OF HEMAGGLUTININ FROM INFLUENZA VIRUS A/SICHUAN/2/1987 (H3N2)
Descriptor:Hemagglutinin, N-ACETYL-D-GLUCOSAMINE, BETA-D-MANNOSE
Authors:Dai, Y.N., Fremont, D.H., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-06-04
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Crystal structure of hemagglutinin from influenza virus A/Sichuan/2/1987 (H3N2)
To Be Published
6PFZ
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STRUCTURE OF A NAD-DEPENDENT PERSULFIDE REDUCTASE FROM A. FULGIDUS
Descriptor:NADH oxidase (NoxA-3), FLAVIN-ADENINE DINUCLEOTIDE, COENZYME A, ...
Authors:Sazinsky, M.H., Shabdar, S., Garcia-Constineiras, A., Crane III, E.J.
Deposit date:2019-06-23
Release date:2020-07-01
Method:X-RAY DIFFRACTION (3.100039 Å)
Cite:Structural and Kinetic Characterization of Hyperthermophilic NADH-Dependent Persulfide Reductase from Archaeoglobus fulgidus
To Be Published
6PG1
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CRYSTAL STRUCTURE OF ECDSBA IN A COMPLEX WITH UNPURIFIED REACTION PRODUCT F1 (METHYLPIPERAZINONE 6)
Descriptor:Thiol:disulfide interchange protein DsbA, 2-methyl-4-{4-[2-(4-methyl-3-oxopiperazin-1-yl)-2-oxoethyl]phenoxy}benzonitrile, COPPER (II) ION, ...
Authors:Ilyichova, O.V., Bentley, M., Doak, B., Scanlon, M.J.
Deposit date:2019-06-23
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Rapid Elaboration of Fragments into Leads by X-ray crystallography (REFiLX)
To Be Published
6PGS
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CRYSTAL STRUCTURE OF BOVINE OPSIN WITH GERANIOL BOUND
Descriptor:Rhodopsin, G alpha CT2 peptide, B-OCTYLGLUCOSIDE, ...
Authors:Eger, B.T., Morizumi, T., Ernst, O.P.
Deposit date:2019-06-24
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2.905 Å)
Cite:Odorant-binding site in visual opsin
To Be Published
6PGY
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MTSL LABELLED T4 LYSOZYME PSEUDO-WILD TYPE K65C MUTANT
Descriptor:Endolysin, CHLORIDE ION, S-[(1-oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl] methanesulfonothioate, ...
Authors:Cuneo, M.J., Myles, D.A., Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PGZ
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MTSL LABELLED T4 LYSOZYME PSEUDO-WILD TYPE V75C MUTANT
Descriptor:Endolysin, S-[(1-oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl] methanesulfonothioate, CHLORIDE ION
Authors:Cuneo, M.J., Myles, D.A., Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PH0
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T4 LYSOZYME PSEUDO-WILD TYPE SOAKED IN TEMPO
Descriptor:Endolysin, CHLORIDE ION, 2-HYDROXYETHYL DISULFIDE
Authors:Cuneo, M.J., Myles, D.A., Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.947 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PH1
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T4 LYSOZYME PSEUDO-WILD TYPE SOAKED IN TEMPOL
Descriptor:Endolysin, CHLORIDE ION, 2-HYDROXYETHYL DISULFIDE, ...
Authors:Cuneo, M.J., Myles, D.A., Li, L.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.632 Å)
Cite:Making hydrogens stand out: Enhanced neutron diffraction from biological crystals using dynamic nuclear polarization
To be published
6PH7
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CRYSTAL STRUCTURE OF BOVINE OPSIN WITH NEROL BOUND
Descriptor:Rhodopsin, G protein CT2 peptide, B-OCTYLGLUCOSIDE, ...
Authors:Eger, B.T., Morizumi, T., Ernst, O.P.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2.902 Å)
Cite:Odorant-binding site in visual opsin
To Be Published
6PHI
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CRYSTAL STRUCTURE OF NATIVE GLUCAGON IN SPACE GROUP I41 AT 1.1 A RESOLUTION
Descriptor:Glucagon, CHLORIDE ION
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHJ
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CRYSTAL STRUCTURE OF NATIVE GLUCAGON IN SPACE GROUP P213 AT 1.99 A RESOLUTION
Descriptor:Glucagon
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHK
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG WITH MONO-STEREOINVERSION AT POSITION 21 (D-ASP21) IN SPACE GROUP I41 AT 1.18 A RESOLUTION
Descriptor:Glucagon
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.18 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHL
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG WITH MONO-STEREOINVERSION AT POSITION 23 (D-VAL23) IN SPACE GROUP I41 AT 1.44 A RESOLUTION
Descriptor:Glucagon
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.443 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHM
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG FULLY COMPOSED OF D-AMINO ACIDS IN SPACE GROUP I41 AT 1.1 A RESOLUTION
Descriptor:D-glucagon, SULFATE ION
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHN
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG COMPOSED OF D-AMINO ACIDS WITH MONO-STEREOINVERSION AT POSITION 23 (L-VAL23) IN SPACE GROUP I41 AT 1.33 A RESOLUTION
Descriptor:D-glucagon L-Val23, SODIUM ION
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.33 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHO
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG WITH SELENOMETHIONINE SUBSTITUTIONS AT POSITION 1 AND 27 IN SPACE GROUP I41 AT 1.42 A RESOLUTION
Descriptor:Glucagon
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHP
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG WITH 4-BROMO-PHENYLALANINE SUBSTITUTIONS AT POSITION 6 AND 22 IN SPACE GROUP I41 AT 1.65 A RESOLUTION
Descriptor:Glucagon
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PHQ
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CRYSTAL STRUCTURE OF GLUCAGON ANALOG FULLY COMPOSED OF D-AMINO ACIDS WITH 4-BROMO-D-PHENYLALANINE SUBSTITUTIONS AT POSITION 6 AND 22 IN SPACE GROUP I41 AT 1.1 A RESOLUTION
Descriptor:D-glucagon D-BrPhe 6,22
Authors:Mroz, P.A., Gonzalez-Gutierrez, G., DiMarchi, R.D.
Deposit date:2019-06-25
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.32 Å)
Cite:High resolution X-ray structure of glucagon and selected stereo-inversed analogs in novel crystallographic packing arrangement.
To Be Published
6PIQ
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CRYSTAL STRUCTURE OF ECDSBA IN A COMPLEX WITH UNPURIFIED REACTION PRODUCT G6 (PYRAZOLE 9)
Descriptor:Thiol:disulfide interchange protein DsbA, 2-[4-(4-cyano-3-methylphenoxy)phenyl]-N-ethyl-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide, COPPER (II) ION
Authors:Ilyichova, O.V., Bentley, M., Doak, B., Scanlon, M.J.
Deposit date:2019-06-26
Release date:2020-07-01
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Rapid Elaboration of Fragments into Leads by X-ray crystallography (REFiLX)
To Be Published
6PJB
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LOPINAVIR
Descriptor:Protease NL4-3, SULFATE ION, N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.984 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published
6PJC
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LR4-41
Descriptor:Protease NL4-3, SULFATE ION, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,4S,5S)-5-{[(2,6-dimethylphenoxy)acetyl]amino}-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.965 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published
6PJD
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LR2-32
Descriptor:Protease NL4-3, SULFATE ION, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,4S,5S)-4-hydroxy-5-{[N-(methoxycarbonyl)-3-methyl-L-valyl]amino}-1,6-diphenylhexan-2-yl]carbamate
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.892 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published
6PJE
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LR2-43
Descriptor:Protease NL4-3, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,4S,5S)-4-hydroxy-5-({1-[(methoxycarbonyl)amino]cyclopentane-1-carbonyl}amino)-1,6-diphenylhexan-2-yl]carbamate, SULFATE ION
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.922 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published
6PJF
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LR2-44
Descriptor:Protease NL4-3, SULFATE ION, methyl [(1S)-1-cyclopentyl-2-({(2S,3S,5S)-5-[({[(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl)amino]-3-hydroxy-1,6-diphenylhexan-2-yl}amino)-2-oxoethyl]carbamate
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published
6PJG
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HIV-1 PROTEASE NL4-3 WT IN COMPLEX WITH LR3-97
Descriptor:Protease NL4-3, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,4S,5S)-4-hydroxy-5-{[N-(methoxycarbonyl)-L-alanyl]amino}-1,6-diphenylhexan-2-yl]carbamate
Authors:Lockbaum, G.J., Rusere, L.N., Henes, M., Kosovrasti, K., Lee, S.K., Spielvogel, E., Nalivaika, E.A., Swanstrom, R., KurtYilmaz, N., Schiffer, C.A., Ali, A.
Deposit date:2019-06-28
Release date:2020-07-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural and Dynamic Analysis of HIV-1 Protease Inhibitors Incorporating Bis-Tetrahydrofuran Moiety in a Pseudo-symmetric Dipeptide Isostere Core
To Be Published