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8HVP
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STRUCTURE AT 2.5-ANGSTROMS RESOLUTION OF CHEMICALLY SYNTHESIZED HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 PROTEASE COMPLEXED WITH A HYDROXYETHYLENE*-BASED INHIBITOR
Descriptor:HIV-1 PROTEASE, INHIBITOR VAL-SER-GLN-ASN-LEU-PSI(CH(OH)-CH2)-VAL-ILE-VAL (U-85548E)
Authors:Jaskolski, M., Miller, M., Tomasselli, A.G., Sawyer, T.K., Staples, D.G., Heinrikson, R.L., Schneider, J., Kent, S.B.H., Wlodawer, A.
Deposit date:1990-10-26
Release date:1993-10-31
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure at 2.5-A resolution of chemically synthesized human immunodeficiency virus type 1 protease complexed with a hydroxyethylene-based inhibitor.
Biochemistry, 30, 1991
7HVP
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X-RAY CRYSTALLOGRAPHIC STRUCTURE OF A COMPLEX BETWEEN A SYNTHETIC PROTEASE OF HUMAN IMMUNODEFICIENCY VIRUS 1 AND A SUBSTRATE-BASED HYDROXYETHYLAMINE INHIBITOR
Descriptor:HIV-1 PROTEASE, INHIBITOR ACE-SER-LEU-ASN-PHE-PSI(CH(OH)-CH2N)-PRO-ILE VME (JG-365)
Authors:Swain, A.L., Miller, M.M., Green, J., Rich, D.H., Schneider, J., Kent, S.B.H., Wlodawer, A.
Deposit date:1990-09-13
Release date:1993-07-15
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:X-ray crystallographic structure of a complex between a synthetic protease of human immunodeficiency virus 1 and a substrate-based hydroxyethylamine inhibitor.
Proc.Natl.Acad.Sci.USA, 87, 1990
5UDP
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HIGH RESOLUTION X-RAY CRYSTAL STRUCTURE OF SYNTHETIC INSULIN LISPRO
Descriptor:Insulin Lispro A chain, Insulin Lispro B chain, PHENOL, ...
Authors:Mandal, K., Dhayalan, B., Kent, S.B.H.
Deposit date:2016-12-28
Release date:2017-01-11
Last modified:2017-09-27
Method:X-RAY DIFFRACTION (1.348 Å)
Cite:Scope and Limitations of Fmoc Chemistry SPPS-Based Approaches to the Total Synthesis of Insulin Lispro via Ester Insulin.
Chemistry, 23, 2017
5I5C
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X-RAY CRYSTAL STRUCTURE OF ALLO-THR31-SHK
Descriptor:Kappa-stichotoxin-She3a, SULFATE ION, LITHIUM ION, ...
Authors:Dang, B., Kubota, T., Manda, K.l., Shen, R., Bezanilla, F., Roux, B., Kent, S.B.H.
Deposit date:2016-02-15
Release date:2017-01-25
Last modified:2017-03-29
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Inversion of the Side-Chain Stereochemistry of Indvidual Thr or Ile Residues in a Protein Molecule: Impact on the Folding, Stability, and Structure of the ShK Toxin.
Angew. Chem. Int. Ed. Engl., 56, 2017
5I5B
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QUASI RACEMIC STRUCTURE OF ALLO-THR13-SHK AND D-SHK
Descriptor:Kappa-stichotoxin-She3a, D-ShK, SULFATE ION, ...
Authors:Dang, B., Kubota, T., Mandal, K., Shen, R., Bezanilla, F., Roux, B., Kent, S.B.H.
Deposit date:2016-02-15
Release date:2017-01-25
Last modified:2017-03-29
Method:X-RAY DIFFRACTION (0.9 Å)
Cite:Inversion of the Side-Chain Stereochemistry of Indvidual Thr or Ile Residues in a Protein Molecule: Impact on the Folding, Stability, and Structure of the ShK Toxin.
Angew. Chem. Int. Ed. Engl., 56, 2017
5I5A
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QUASI RACEMIC STRUCTURE OF ALLO-ILE7-SHK AND D-SHK
Descriptor:Kappa-stichotoxin-She3a, D-ShK, GLYCEROL, ...
Authors:Dang, B., Kubota, T., Mandal, K., Shen, R., Bezanilla, F., Roux, B., Kent, S.B.H.
Deposit date:2016-02-14
Release date:2017-01-25
Last modified:2017-03-29
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Inversion of the Side-Chain Stereochemistry of Indvidual Thr or Ile Residues in a Protein Molecule: Impact on the Folding, Stability, and Structure of the ShK Toxin.
Angew. Chem. Int. Ed. Engl., 56, 2017
5HHD
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CRYSTAL STRUCTURE OF CHEMICALLY SYNTHESIZED HETEROCHIRAL {RFX037 PLUS VEGF-A} PROTEIN COMPLEX IN SPACE GROUP P21
Descriptor:Vascular endothelial growth factor A, D-Peptide RFX037.D, D-Vascular endothelial growth factor, ...
Authors:Uppalapati, M., LEE, D.J., Mandal, K., Kent, S.B.H., Sidhu, S.
Deposit date:2016-01-10
Release date:2016-03-09
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A Potent d-Protein Antagonist of VEGF-A is Nonimmunogenic, Metabolically Stable, and Longer-Circulating in Vivo.
Acs Chem.Biol., 11, 2016
5HHC
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CRYSTAL STRUCTURE OF CHEMICALLY SYNTHESIZED HETEROCHIRAL {RFX037 PLUS VEGF-A} PROTEIN COMPLEX IN SPACE GROUP P21/N
Descriptor:Vascular endothelial growth factor A, D- Vascular endothelial growth factor-A, GLYCEROL
Authors:Uppalapati, M., Lee, D.J., Mandal, K., Kent, S.B.H., Sidhu, S.
Deposit date:2016-01-10
Release date:2016-03-09
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:A Potent d-Protein Antagonist of VEGF-A is Nonimmunogenic, Metabolically Stable, and Longer-Circulating in Vivo.
Acs Chem.Biol., 11, 2016
5ENA
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XRAY CRYSTAL STRUCTURE OF ISOTOPE-LABELED HUMAN INSULIN
Descriptor:Insulin chain A, Insulin chain B
Authors:Mandal, K., Dhayalan, B., Avital-Shmilovici, M., Tokmakoff, A., Kent, S.B.H.
Deposit date:2015-11-09
Release date:2016-01-13
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Crystallization of Enantiomerically Pure Proteins from Quasi-Racemic Mixtures: Structure Determination by X-Ray Diffraction of Isotope-Labeled Ester Insulin and Human Insulin.
Chembiochem, 17, 2016
5EN9
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HIGH RESOLUTION X-RAY CRYSTAL STRUCTURE OF ISOTOPE-LABELED ESTER-INSULIN
Descriptor:Insulin chain A, Insulin chain B
Authors:Mandal, K., Dhayalan, B., Avital-Shmilovici, M., Tokmakoff, A., Kent, S.B.H.
Deposit date:2015-11-09
Release date:2016-01-13
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Crystallization of Enantiomerically Pure Proteins from Quasi-Racemic Mixtures: Structure Determination by X-Ray Diffraction of Isotope-Labeled Ester Insulin and Human Insulin.
Chembiochem, 17, 2016
4WSP
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RACEMIC CRYSTAL STRUCTURE OF RV1738 FROM MYCOBACTERIUM TUBERCULOSIS (FORM-I)
Descriptor:protein DL-Rv1738, CHLORIDE ION
Authors:Bunker, R.D., Mandal, K., Kent, S.B.H., Baker, E.N.
Deposit date:2014-10-28
Release date:2015-03-18
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:A functional role of Rv1738 in Mycobacterium tuberculosis persistence suggested by racemic protein crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
4WPY
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RACEMIC CRYSTAL STRUCTURE OF RV1738 FROM MYCOBACTERIUM TUBERCULOSIS (FORM-II)
Descriptor:protein DL-Rv1738, trifluoroacetic acid, GLYCEROL
Authors:Bunker, R.D., Mandal, K., Kent, S.B.H., Baker, E.N.
Deposit date:2014-10-21
Release date:2015-03-18
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:A functional role of Rv1738 in Mycobacterium tuberculosis persistence suggested by racemic protein crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
4PHV
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X-RAY CRYSTAL STRUCTURE OF THE HIV PROTEASE COMPLEX WITH L-700,417, AN INHIBITOR WITH PSEUDO C2 SYMMETRY
Descriptor:HIV-1 PROTEASE, N,N-BIS(2-HYDROXY-1-INDANYL)-2,6- DIPHENYLMETHYL-4-HYDROXY-1,7-HEPTANDIAMIDE
Authors:Bone, R.
Deposit date:1991-10-04
Release date:1993-10-31
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:X-Ray Crystal Structure of the HIV Protease Complex with L-700,417, an Inhibitor with Pseudo C2 Symmetry
J.Am.Chem.Soc., 113, 1991
4OIK
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(QUASI-)RACEMIC X-RAY CRYSTAL STRUCTURE OF GLYCOSYLATED CHEMOKINE SER-CCL1.
Descriptor:C-C motif chemokine 1, D-Ser-CCL1, N-ACETYL-D-GLUCOSAMINE, ...
Authors:Okamoto, R., Mandal, K., Sawaya, M.R., Kajihara, Y., Yeates, T.O., Kent, S.B.H.
Deposit date:2014-01-19
Release date:2014-05-07
Last modified:2014-05-21
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:(Quasi-)Racemic X-ray Structures of Glycosylated and Non-Glycosylated Forms of the Chemokine Ser-CCL1 Prepared by Total Chemical Synthesis.
Angew.Chem.Int.Ed.Engl., 53, 2014
4OIJ
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X-RAY CRYSTAL STRUCTURE OF RACEMIC NON-GLYCOSYLATED CHEMOKINE SER-CCL1
Descriptor:C-C motif chemokine 1, D-Ser-CCL1, SULFATE ION
Authors:Okamoto, R., Mandal, K., Sawaya, M.R., Kajihara, Y., Yeates, T.O., Kent, S.B.H.
Deposit date:2014-01-19
Release date:2014-05-07
Last modified:2014-05-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:(Quasi-)Racemic X-ray Structures of Glycosylated and Non-Glycosylated Forms of the Chemokine Ser-CCL1 Prepared by Total Chemical Synthesis.
Angew.Chem.Int.Ed.Engl., 53, 2014
4LFS
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HIGH RESOLUTION X-RAY STRUCTURE OF RACEMIC SHK TOXIN
Descriptor:Potassium channel toxin ShK, CHLORIDE ION, GLYCEROL
Authors:Dang, B., Kubota, T., Mandal, K., Bezanilla, F., Kent, S.B.H.
Deposit date:2013-06-27
Release date:2013-08-14
Last modified:2013-09-04
Method:X-RAY DIFFRACTION (0.97 Å)
Cite:Native Chemical Ligation at Asx-Cys, Glx-Cys: Chemical Synthesis and High-Resolution X-ray Structure of ShK Toxin by Racemic Protein Crystallography.
J.Am.Chem.Soc., 135, 2013
4LFQ
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HIGH RESOLUTION X-RAY CRYSTAL STRUCTURE OF L-SHK TOXIN
Descriptor:Potassium channel toxin ShK
Authors:Dang, B., Kubota, T., Mandal, K., Bezanilla, F., Kent, S.B.H.
Deposit date:2013-06-27
Release date:2013-08-14
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.059 Å)
Cite:Native Chemical Ligation at Asx-Cys, Glx-Cys: Chemical Synthesis and High-Resolution X-ray Structure of ShK Toxin by Racemic Protein Crystallography.
J.Am.Chem.Soc., 135, 2013
4IUZ
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HIGH RESOLUTION CRYSTAL STRUCTURE OF RACEMIC ESTER INSULIN
Descriptor:Insulin A chain, Insulin B chain, DI(HYDROXYETHYL)ETHER, ...
Authors:Avital-Shmilovici, M., Mandal, K., Gates, Z.P., Phillips, N., Weiss, M.A., Kent, S.B.H.
Deposit date:2013-01-22
Release date:2013-02-13
Last modified:2013-03-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Fully Convergent Chemical Synthesis of Ester Insulin: Determination of the High Resolution X-ray Structure by Racemic Protein Crystallography.
J.Am.Chem.Soc., 135, 2013
4HVP
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STRUCTURE OF COMPLEX OF SYNTHETIC HIV-1 PROTEASE WITH A SUBSTRATE-BASED INHIBITOR AT 2.3 ANGSTROMS RESOLUTION
Descriptor:HIV-1 PROTEASE, N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide
Authors:Miller, M., Schneider, J., Sathyanarayana, B.K., Toth, M.V., Marshall, G.R., Clawson, L., Selk, L., Kent, S.B.H., Wlodawer, A.
Deposit date:1989-08-08
Release date:1990-04-15
Last modified:2017-11-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structure of complex of synthetic HIV-1 protease with a substrate-based inhibitor at 2.3 A resolution.
Science, 246, 1989
4GLU
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CRYSTAL STRUCTURE OF THE MIRROR IMAGE FORM OF VEGF-A
Descriptor:D- Vascular endothelial growth factor-A, ACETATE ION, trifluoroacetic acid, ...
Authors:Mandal, K., Uppalapati, M., Ault-Riche, D., Kenney, J., Lowitz, J., Sidhu, S., Kent, S.B.H.
Deposit date:2012-08-14
Release date:2012-09-05
Last modified:2013-11-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Chemical synthesis and X-ray structure of a heterochiral {D-protein antagonist plus vascular endothelial growth factor} protein complex by racemic crystallography.
Proc.Natl.Acad.Sci.USA, 109, 2012
4GLS
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CRYSTAL STRUCTURE OF CHEMICALLY SYNTHESIZED HETEROCHIRAL {D-PROTEIN ANTAGONIST PLUS VEGF-A} PROTEIN COMPLEX IN SPACE GROUP P21
Descriptor:D- Vascular endothelial growth factor-A, L- RFX001, D- RFX001, ...
Authors:Mandal, K., Uppalapati, M., Ault-Riche, D., Kenney, J., Lowitz, J., Sidhu, S., Kent, S.B.H.
Deposit date:2012-08-14
Release date:2012-09-05
Last modified:2013-11-27
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Chemical synthesis and X-ray structure of a heterochiral {D-protein antagonist plus vascular endothelial growth factor} protein complex by racemic crystallography.
Proc.Natl.Acad.Sci.USA, 109, 2012
4GLN
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CRYSTAL STRUCTURE OF CHEMICALLY SYNTHESIZED HETEROCHIRAL {D-PROTEIN ANTAGONIST PLUS VEGF-A} PROTEIN COMPLEX IN SPACE GROUP P21/N
Descriptor:D-RFX001, Vascular endothelial growth factor A
Authors:Mandal, K., Uppalapati, M., Ault-Riche, D., Kenney, J., Lowitz, J., Sidhu, S., Kent, S.B.H.
Deposit date:2012-08-14
Release date:2012-09-05
Last modified:2019-04-24
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Chemical synthesis and X-ray structure of a heterochiral {D-protein antagonist plus vascular endothelial growth factor} protein complex by racemic crystallography.
Proc.Natl.Acad.Sci.USA, 109, 2012
3UE7
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X-RAY CRYSTAL STRUCTURE OF A NOVEL TOPOLOGICAL ANALOGUE OF CRAMBIN
Descriptor:D-Crambin, Crambin
Authors:Mandal, K., Pentelute, B.L., Bang, D., Gates, Z.P., Torbeev, V.Y., Kent, S.B.H.
Deposit date:2011-10-28
Release date:2012-02-08
Last modified:2012-02-15
Method:X-RAY DIFFRACTION (1.08 Å)
Cite:Design, total chemical synthesis, and x-ray structure of a protein having a novel linear-loop polypeptide chain topology.
Angew.Chem.Int.Ed.Engl., 51, 2012
3QTK
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THE CRYSTAL STRUCTURE OF CHEMICALLY SYNTHESIZED VEGF-A
Descriptor:Vascular endothelial growth factor A, ACETATE ION, trifluoroacetic acid, ...
Authors:Mandal, K., Kent, S.B.H.
Deposit date:2011-02-22
Release date:2011-07-27
Last modified:2012-10-17
Method:X-RAY DIFFRACTION (1.849 Å)
Cite:Total chemical synthesis of biologically active vascular endothelial growth factor.
Angew.Chem.Int.Ed.Engl., 50, 2011
3ODV
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X-RAY STRUCTURE OF KALIOTOXIN BY RACEMIC PROTEIN CRYSTALLOGRAPHY
Descriptor:Potassium channel toxin alpha-KTx 3.1, trifluoroacetic acid, CITRIC ACID
Authors:Pentelute, B.L., Mandal, K., Gates, Z.P., Sawaya, M.R., Yeates, T.O., Kent, S.B.H.
Deposit date:2010-08-11
Release date:2010-10-20
Last modified:2012-03-28
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Total chemical synthesis and X-ray structure of kaliotoxin by racemic protein crystallography.
Chem.Commun.(Camb.), 46, 2010
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