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Crystal Structure of HIV-1 PRS17 with GRL-44-10A
Descriptor:	(3R,3aS,4R,6aR)-4-methoxyhexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate, CHLORIDE ION, GLYCEROL, ...
Authors:	Agniswamy, J, Weber, I.T.
Deposit date:	2021-05-21
Release date:	2021-07-28
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.65 Å)
Cite:	Novel HIV PR inhibitors with C4-substituted bis-THF and bis-fluoro-benzyl target the two active site mutations of highly drug resistant mutant PR S17 . Biochem.Biophys.Res.Commun., 566, 2021

7N6T

Crystal structure of inhibitor-free HIV-1 PRS17 revertant mutant PRS17 V48G
Descriptor:	Protease
Authors:	Burnaman, S.H, Wang, Y.-F, Weber, I.T.
Deposit date:	2021-06-09
Release date:	2021-09-08
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.32 Å)
Cite:	Revertant mutation V48G alters conformational dynamics of highly drug resistant HIV protease PRS17. J.Mol.Graph.Model., 108, 2021

7N6V

Crystal structure of HIV-1 Protease multiple mutants PRS17 with Revertant mutation V48G bound to inhibitor Amprenavir
Descriptor:	GLYCEROL, Protease, {3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YL ESTER
Authors:	Burnaman, S.H, Wang, Y.-F, Weber, I.T.
Deposit date:	2021-06-09
Release date:	2021-09-08
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.39 Å)
Cite:	Revertant mutation V48G alters conformational dynamics of highly drug resistant HIV protease PRS17. J.Mol.Graph.Model., 108, 2021

7N6X

Crystal structure of HIV-1 Protease multiple mutants PRS17 bound to inhibitor Amprenavir
Descriptor:	Protease, {3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YL ESTER
Authors:	Burnaman, S.H, Wang, Y.-F, Weber, I.T.
Deposit date:	2021-06-09
Release date:	2021-09-08
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.47 Å)
Cite:	Revertant mutation V48G alters conformational dynamics of highly drug resistant HIV protease PRS17. J.Mol.Graph.Model., 108, 2021

7MYY

Crystal Structure of HIV-1 PRS17 with GRL-142
Descriptor:	(3S,3aR,5R,7aS,8S)-hexahydro-4H-3,5-methanofuro[2,3-b]pyran-8-yl [(2S,3R)-4-[{[2-(cyclopropylamino)-1,3-benzothiazol-6-yl]sulfonyl}(2-methylpropyl)amino]-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]carbamate, CHLORIDE ION, GLYCEROL, ...
Authors:	Agniswamy, J, Weber, I.T.
Deposit date:	2021-05-22
Release date:	2021-07-28
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.5 Å)
Cite:	Novel HIV PR inhibitors with C4-substituted bis-THF and bis-fluoro-benzyl target the two active site mutations of highly drug resistant mutant PR S17 . Biochem.Biophys.Res.Commun., 566, 2021

4HDF

Crystal Structure of HIV-1 protease mutants V82A complexed with inhibitor GRL-0519
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, CHLORIDE ION, HIV-1 Protease
Authors:	Zhang, H, Wang, Y.-F, Weber, I.T.
Deposit date:	2012-10-02
Release date:	2013-08-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.29 Å)
Cite:	Novel P2 tris-tetrahydrofuran group in antiviral compound 1 (GRL-0519) fills the S2 binding pocket of selected mutants of HIV-1 protease. J.Med.Chem., 56, 2013

4FM6

HIV-1 protease mutant V32I complexed with reaction intermediate
Descriptor:	CHLORIDE ION, GLYCEROL, HIV-1 protease, ...
Authors:	Shen, C.H, Weber, I.T.
Deposit date:	2012-06-15
Release date:	2012-10-17
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Capturing the Reaction Pathway in Near-Atomic-Resolution Crystal Structures of HIV-1 Protease. Biochemistry, 51, 2012

4HDP

Crystal Structure of HIV-1 protease mutants I50V complexed with inhibitor GRL-0519
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, CHLORIDE ION, HIV-1 Protease, ...
Authors:	Shen, C.H, Zhang, H, Weber, I.T.
Deposit date:	2012-10-02
Release date:	2013-08-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.22 Å)
Cite:	Novel P2 tris-tetrahydrofuran group in antiviral compound 1 (GRL-0519) fills the S2 binding pocket of selected mutants of HIV-1 protease. J.Med.Chem., 56, 2013

4HE9

Crystal Structure of HIV-1 protease mutants I54M complexed with inhibitor GRL-0519
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, CHLORIDE ION, HIV-1 protease, ...
Authors:	Shen, C.H, Zhang, H, Weber, I.T.
Deposit date:	2012-10-03
Release date:	2013-08-21
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.06 Å)
Cite:	Novel P2 tris-tetrahydrofuran group in antiviral compound 1 (GRL-0519) fills the S2 binding pocket of selected mutants of HIV-1 protease. J.Med.Chem., 56, 2013

4HEG

Crystal Structure of HIV-1 protease mutants R8Q complexed with inhibitor GRL-0519
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, HIV-1 protease
Authors:	Zhang, H, Wang, Y.-F, Weber, I.T.
Deposit date:	2012-10-03
Release date:	2013-08-21
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.46 Å)
Cite:	Novel P2 tris-tetrahydrofuran group in antiviral compound 1 (GRL-0519) fills the S2 binding pocket of selected mutants of HIV-1 protease. J.Med.Chem., 56, 2013

4HDB

Crystal Structure of HIV-1 protease mutants D30N complexed with inhibitor GRL-0519
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, CHLORIDE ION, HIV-1 Protease, ...
Authors:	Zhang, H, Wang, Y.-F, Shen, C.H, Agniswamy, J, Weber, I.T.
Deposit date:	2012-10-02
Release date:	2013-08-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.49 Å)
Cite:	Novel P2 tris-tetrahydrofuran group in antiviral compound 1 (GRL-0519) fills the S2 binding pocket of selected mutants of HIV-1 protease. J.Med.Chem., 56, 2013

4J5J

Crystal Structure of Multidrug Resistant HIV-1 Protease Clinical Isolate PR20 in Complex with Amprenavir
Descriptor:	CHLORIDE ION, Protease, {3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YL ESTER
Authors:	Shen, C.H, Weber, I.T.
Deposit date:	2013-02-08
Release date:	2013-05-15
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Extreme Multidrug Resistant HIV-1 Protease with 20 Mutations Is Resistant to Novel Protease Inhibitors with P1'-Pyrrolidinone or P2-Tris-tetrahydrofuran. J.Med.Chem., 56, 2013

4J55

Crystal Structure of Multidrug Resistant HIV-1 Protease Clinical isolate PR20 with the potent antiviral inhibitor GRL-02031
Descriptor:	(3aS,5R,6aR)-hexahydro-2H-cyclopenta[b]furan-5-yl [(1S,2R)-1-benzyl-2-hydroxy-3-([(4-methoxyphenyl)sulfonyl]{[(2R)-5-oxopyrrolidin-2-yl]methyl}amino)propyl]carbamate, Protease
Authors:	Wang, Y.-F, Agniswamy, J, Weber, I.T.
Deposit date:	2013-02-07
Release date:	2013-05-15
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.31 Å)
Cite:	Extreme Multidrug Resistant HIV-1 Protease with 20 Mutations Is Resistant to Novel Protease Inhibitors with P1'-Pyrrolidinone or P2-Tris-tetrahydrofuran. J.Med.Chem., 56, 2013

1BAI

Crystal structure of Rous sarcoma virus protease in complex with inhibitor
Descriptor:	N-[(2R)-2-({N~5~-[amino(iminio)methyl]-L-ornithyl-L-valyl}amino)-4-methylpentyl]-L-phenylalanyl-L-alpha-glutamyl-L-alanyl-L-norleucinamide, PROTEASE
Authors:	Wu, J, Adomat, J.M, Ridky, T.W, Louis, J.M, Leis, J, Harrison, R.W, Weber, I.T.
Deposit date:	1998-04-17
Release date:	1999-01-13
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.4 Å)
Cite:	Structural basis for specificity of retroviral proteases. Biochemistry, 37, 1998

1TQH

Covalent Reaction intermediate Revealed in Crystal Structure of the Geobacillus stearothermophilus Carboxylesterase Est30
Descriptor:	Carboxylesterase precursor, PROPYL ACETATE, SULFATE ION
Authors:	Liu, P, Wang, Y.F, Ewis, H.E, Abdelal, A.T, Lu, C.D, Harrison, R.W, Weber, I.T.
Deposit date:	2004-06-17
Release date:	2004-09-28
Last modified:	2017-10-11
Method:	X-RAY DIFFRACTION (1.63 Å)
Cite:	Covalent reaction intermediate revealed in crystal structure of the Geobacillus stearothermophilus carboxylesterase Est30. J.Mol.Biol., 342, 2004

1SDV

Crystal structures of HIV protease V82A and L90M mutants reveal changes in indinavir binding site.
Descriptor:	CHLORIDE ION, N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE, protease RETROPEPSIN
Authors:	Mahalingam, B, Wang, Y.-F, Boross, P.I, Tozser, J, Louis, J.M, Harrison, R.W, Weber, I.T.
Deposit date:	2004-02-14
Release date:	2004-05-25
Last modified:	2023-08-23
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Crystal structures of HIV protease V82A and L90M mutants reveal changes in the indinavir-binding site Eur.J.Biochem., 271, 2004

1A94

STRUCTURAL BASIS FOR SPECIFICITY OF RETROVIRAL PROTEASES
Descriptor:	N-[(2R)-2-({N~5~-[amino(iminio)methyl]-L-ornithyl-L-valyl}amino)-4-methylpentyl]-L-phenylalanyl-L-alpha-glutamyl-L-alanyl-L-norleucinamide, PROTEASE
Authors:	Wu, J, Adomat, J.M, Ridky, T.W, Louis, J.M, Leis, J, Harrison, R.W, Weber, I.T.
Deposit date:	1998-04-16
Release date:	1999-01-13
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Structural basis for specificity of retroviral proteases. Biochemistry, 37, 1998

1A1X

CRYSTAL STRUCTURE OF MTCP-1 INVOLVED IN T CELL MALIGNANCIES
Descriptor:	HMTCP-1
Authors:	Fu, Z.Q, Dubois, G.C, Song, S.P, Kulikovskaya, I, Virgilio, L, Rothstein, J, Croce, C.M, Weber, I.T, Harrison, R.W.
Deposit date:	1997-12-18
Release date:	1998-05-27
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Crystal structure of MTCP-1: implications for role of TCL-1 and MTCP-1 in T cell malignancies. Proc.Natl.Acad.Sci.USA, 95, 1998

1D77

CRYSTAL STRUCTURE OF A B-DNA DODECAMER CONTAINING INOSINE, D(CGCIAATTCGCG), AT 2.4 ANGSTROMS RESOLUTION AND ITS COMPARISON WITH OTHER B-DNA DODECAMERS
Descriptor:	DNA (5'-D(CPGPCPIPAPAPTPTPCPGPCPG)-3')
Authors:	Xuan, J.C, Weber, I.T.
Deposit date:	1992-05-30
Release date:	1993-07-15
Last modified:	2024-02-07
Method:	X-RAY DIFFRACTION (2.4 Å)
Cite:	Crystal structure of a B-DNA dodecamer containing inosine, d(CGCIAATTCGCG), at 2.4 A resolution and its comparison with other B-DNA dodecamers. Nucleic Acids Res., 20, 1992

1SDU

Crystal structures of HIV protease V82A and L90M mutants reveal changes in indinavir binding site.
Descriptor:	ACETATE ION, N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE, SULFATE ION, ...
Authors:	Mahalingam, B, Wang, Y.-F, Boross, P.I, Tozser, J, Louis, J.M, Harrison, R.W, Weber, I.T.
Deposit date:	2004-02-14
Release date:	2004-05-25
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (1.25 Å)
Cite:	Crystal structures of HIV protease V82A and L90M mutants reveal changes in the indinavir-binding site Eur.J.Biochem., 271, 2004

1SDT

Crystal structures of HIV protease V82A and L90M mutants reveal changes in indinavir binding site.
Descriptor:	CHLORIDE ION, N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE, protease RETROPEPSIN
Authors:	Mahalingam, B, Wang, Y.-F, Boross, P.I, Tozser, J, Louis, J.M, Harrison, R.W, Weber, I.T.
Deposit date:	2004-02-14
Release date:	2004-05-25
Last modified:	2023-08-23
Method:	X-RAY DIFFRACTION (1.3 Å)
Cite:	Crystal structures of HIV protease V82A and L90M mutants reveal changes in the indinavir-binding site Eur.J.Biochem., 271, 2004

4J54

Crystal Structure of Multidrug Resistant HIV-1 Protease Clinical isolate PR20 with the potent antiviral inhibitor GRL-0519A
Descriptor:	(3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate, ACETATE ION, IODIDE ION, ...
Authors:	Wang, Y.-F, Agniswamy, J, Weber, I.T.
Deposit date:	2013-02-07
Release date:	2013-05-15
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.55 Å)
Cite:	Extreme Multidrug Resistant HIV-1 Protease with 20 Mutations Is Resistant to Novel Protease Inhibitors with P1'-Pyrrolidinone or P2-Tris-tetrahydrofuran. J.Med.Chem., 56, 2013

4L1I

Crystal structure of EGFP-based Calcium Sensor CatchER complexed with Ca
Descriptor:	CALCIUM ION, EGFP-based Calcium Sensor CatchER
Authors:	Zhang, Y, Weber, I.T.
Deposit date:	2013-06-03
Release date:	2013-12-11
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.2 Å)
Cite:	Structural basis for a hand-like site in the calcium sensor CatchER with fast kinetics. Acta Crystallogr.,Sect.D, 69, 2013

4L12

Crystal structure of EGFP-based Calcium Sensor CatchER complexed with Gd
Descriptor:	EGFP-based Calcium Sensor CatchER, GADOLINIUM ATOM
Authors:	Zhang, Y, Weber, I.T.
Deposit date:	2013-06-01
Release date:	2013-12-11
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.78 Å)
Cite:	Structural basis for a hand-like site in the calcium sensor CatchER with fast kinetics. Acta Crystallogr.,Sect.D, 69, 2013

4L13

Crystal structure of Ligand Free EGFP-based Calcium Sensor CatchER
Descriptor:	ACETIC ACID, EGFP-based Calcium Sensor CatchER
Authors:	Zhang, Y, Weber, I.T.
Deposit date:	2013-06-01
Release date:	2013-12-11
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.66 Å)
Cite:	Structural basis for a hand-like site in the calcium sensor CatchER with fast kinetics. Acta Crystallogr.,Sect.D, 69, 2013

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Total results:	261
Displayed results:	25
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