Author results

1OZ6
  • Download 1oz6
  • View 1oz6
Molmil generated image of 1oz6
X-RAY STRUCTURE OF ACIDIC PHOSPHOLIPASE A2 FROM INDIAN SAW-SCALED VIPER (ECHIS CARINATUS) WITH A POTENT PLATELET AGGREGATION INHIBITORY ACTIVITY
Descriptor:phospholipase A2, CALCIUM ION
Authors:Jasti, J., Paramasivam, M., Srinivasan, A., Singh, T.P.
Deposit date:2003-04-08
Release date:2003-12-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure of an acidic phospholipase A2 from Indian saw-scaled viper (Echis carinatus) at 2.6 A resolution reveals a novel intermolecular interaction.
Acta Crystallogr.,Sect.D, 60, 2004
1OZ7
  • Download 1oz7
  • View 1oz7
Molmil generated image of 1oz7
CRYSTAL STRUCTURE OF ECHICETIN FROM THE VENOM OF INDIAN SAW-SCALED VIPER (ECHIS CARINATUS) AT 2.4 RESOLUTION
Descriptor:echicetin A-chain, echicetin B-chain
Authors:Jasti, J., Paramasivam, M., Srinivasan, A., Singh, T.P.
Deposit date:2003-04-08
Release date:2003-12-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of echicetin from Echis carinatus (Indian saw-scaled viper) at 2.4A resolution.
J.Mol.Biol., 335, 2004
2QTS
  • Download 2qts
  • View 2qts
Molmil generated image of 2qts
STRUCTURE OF AN ACID-SENSING ION CHANNEL 1 AT 1.9 A RESOLUTION AND LOW PH
Descriptor:Acid-sensing ion channel, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Jasti, J., Furukawa, H., Gonzales, E.B., Gouaux, E.
Deposit date:2007-08-02
Release date:2007-09-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure of acid-sensing ion channel 1 at 1.9A resolution and low pH
Nature, 449, 2007
5VIL
  • Download 5vil
  • View 5vil
Molmil generated image of 5vil
CRYSTAL STRUCTURE OF ASK1 KINASE DOMAIN WITH A POTENT INHIBITOR (ANALOG 6)
Descriptor:Mitogen-activated protein kinase kinase kinase 5, 2-methoxy-N-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}-5-sulfamoylbenzamide, DIMETHYL SULFOXIDE
Authors:Jasti, J., Chang, J., Kurumbail, R.
Deposit date:2017-04-17
Release date:2018-01-17
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2.64 Å)
Cite:Rational approach to highly potent and selective apoptosis signal-regulating kinase 1 (ASK1) inhibitors.
Eur J Med Chem, 145, 2017
5VIO
  • Download 5vio
  • View 5vio
Molmil generated image of 5vio
CRYSTAL STRUCTURE OF ASK1 KINASE DOMAIN WITH A POTENT INHIBITOR (ANALOG 13)
Descriptor:Mitogen-activated protein kinase kinase kinase 5, 4-methoxy-N~1~-methyl-N~3~-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}benzene-1,3-dicarboxamide
Authors:Jasti, J., Chang, J., Kurumbail, R.
Deposit date:2017-04-17
Release date:2018-01-17
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (2.84 Å)
Cite:Rational approach to highly potent and selective apoptosis signal-regulating kinase 1 (ASK1) inhibitors.
Eur J Med Chem, 145, 2017
4U8Z
  • Download 4u8z
  • View 4u8z
Molmil generated image of 4u8z
CRYSTAL STRUCTURE OF MST3 WITH A PYRROLOPYRIMIDINE INHIBITOR (PF-06447475)
Descriptor:Serine/threonine-protein kinase 24, MANGANESE (II) ION, 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile
Authors:Jasti, J., Song, X., Griffor, M., Kurumbail, R.G.
Deposit date:2014-08-05
Release date:2015-03-18
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Discovery and preclinical profiling of 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile (PF-06447475), a highly potent, selective, brain penetrant, and in vivo active LRRK2 kinase inhibitor.
J.Med.Chem., 58, 2015
4W8D
  • Download 4w8d
  • View 4w8d
Molmil generated image of 4w8d
CRYSTAL STRUCTURE OF MST3 WITH A PYRROLOPYRIMIDINE INHIBITOR (PF-06454589).
Descriptor:Serine/threonine-protein kinase 24 36 kDa subunit, 5-(1-methyl-1H-pyrazol-4-yl)-4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidine
Authors:Jasti, J., Song, X., Griffor, M., Kurumbail, R.G.
Deposit date:2014-08-24
Release date:2015-03-18
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Discovery and preclinical profiling of 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile (PF-06447475), a highly potent, selective, brain penetrant, and in vivo active LRRK2 kinase inhibitor.
J.Med.Chem., 58, 2015
4W8E
  • Download 4w8e
  • View 4w8e
Molmil generated image of 4w8e
STRUCTURE OF MST3 WITH A PYRROLOPYRIMIDINE INHIBITOR (PF-06645342)
Descriptor:Serine/threonine-protein kinase 24 36 kDa subunit, 3-{4-[(2R)-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile
Authors:Jasti, J., Song, X., Griffor, M., Kurumbail, R.G.
Deposit date:2014-08-24
Release date:2015-03-18
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Discovery and preclinical profiling of 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile (PF-06447475), a highly potent, selective, brain penetrant, and in vivo active LRRK2 kinase inhibitor.
J.Med.Chem., 58, 2015
1KPM
  • Download 1kpm
  • View 1kpm
Molmil generated image of 1kpm
FIRST STRUCTURAL EVIDENCE OF A SPECIFIC INHIBITION OF PHOSPHOLIPASE A2 BY VITAMIN E AND ITS IMPLICATIONS IN INFLAMMATION: CRYSTAL STRUCTURE OF THE COMPLEX FORMED BETWEEN PHOSPHOLIPASE A2 AND VITAMIN E AT 1.8 A RESOLUTION.
Descriptor:Phospholipase A2, VITAMIN E, ACETIC ACID
Authors:Chandra, V., Jasti, J., Kaur, P., Betzel, C., Srinivasan, A., Singh, T.P.
Deposit date:2002-01-01
Release date:2002-07-10
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:First Structural Evidence of a Specific Inhibition of Phospholipase A2 by alpha-Tocopherol (Vitamin E) and its Implications in Inflammation: Crystal Structure of the Complex Formed Between Phospholipase A2 and alpha-Tocopherol at 1.8 A Resolution
J.Mol.Biol., 320, 2002
1JQ9
  • Download 1jq9
  • View 1jq9
Molmil generated image of 1jq9
CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN PHOSPHOLIPASE A2 FROM DABOIA RUSSELLI PULCHELLA AND A DESIGNED PENTAPEPTIDE PHE-LEU-SER-TYR-LYS AT 1.8 RESOLUTION
Descriptor:Phospholipase A2, Peptide inhibitor, ACETIC ACID
Authors:Chandra, V., Jasti, J., Kaur, P., Dey, S., Betzel, C., Singh, T.P.
Deposit date:2001-08-04
Release date:2002-11-06
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structure of a Complex Formed between a Snake Venom Phospholipase A2 and a Potent Peptide Inhibitor Phe-Leu-Ser-Tyr-Lys at 1.8 A Resolution
J.BIOL.CHEM., 277, 2002
1JQ8
  • Download 1jq8
  • View 1jq8
Molmil generated image of 1jq8
DESIGN OF SPECIFIC INHIBITORS OF PHOSPHOLIPASE A2: CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN PHOSPHOLIPASE A2 FROM DABOIA RUSSELLI PULCHELLA AND A DESIGNED PENTAPEPTIDE LEU-ALA-ILE-TYR-SER AT 2.0 RESOLUTION
Descriptor:Phospholipase A2, Peptide inhibitor, SULFATE ION, ...
Authors:Chandra, V., Jasti, J., Kaur, P., Dey, S., Betzel, C., Singh, T.P.
Deposit date:2001-08-04
Release date:2002-11-06
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2 Å)
Cite:Design of specific peptide inhibitors of phospholipase A2: structure of a complex formed between Russell's viper phospholipase A2 and a designed peptide Leu-Ala-Ile-Tyr-Ser (LAIYS).
ACTA CRYSTALLOGR.,SECT.D, 58, 2002
1FV0
  • Download 1fv0
  • View 1fv0
Molmil generated image of 1fv0
FIRST STRUCTURAL EVIDENCE OF THE INHIBITION OF PHOSPHOLIPASE A2 BY ARISTOLOCHIC ACID: CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN PHOSPHOLIPASE A2 AND ARISTOLOCHIC ACID
Descriptor:PHOSPHOLIPASE A2, SULFATE ION, ACETATE ION, ...
Authors:Chandra, V., Jasti, J., Kaur, P., Srinivasan, A., Betzel, C., Singh, T.P.
Deposit date:2000-09-18
Release date:2002-08-28
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural Basis of Phospholipase A2 Inhibition for the Synthesis of Prostaglandins by the Plant Alkaloid Aristolochic Acid from a 1.7 A Crystal Structure
Biochemistry, 41, 2002
1NKX
  • Download 1nkx
  • View 1nkx
Molmil generated image of 1nkx
CRYSTAL STRUCTURE OF A PROTEOLYTICALLY GENERATED FUNCTIONAL MONOFERRIC C-LOBE OF BOVINE LACTOFERRIN AT 1.9A RESOLUTION
Descriptor:LACTOTRANSFERRIN, N-ACETYL-D-GLUCOSAMINE, BETA-D-MANNOSE, ...
Authors:Sharma, S., Jasti, J., Kumar, J., Mohanty, A.K., Singh, T.P.
Deposit date:2003-01-06
Release date:2003-09-02
Last modified:2018-08-22
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structure of a Proteolytically Generated Functional Monoferric C-lobe of Bovine Lactoferrin at 1.9A Resolution
J.Mol.Biol., 331, 2003
1OWQ
  • Download 1owq
  • View 1owq
Molmil generated image of 1owq
CRYSTAL STRUCTURE OF A 40 KDA SIGNALLING PROTEIN (SPC-40) SECRETED DURING INVOLUTION
Descriptor:signal processing protein, N-ACETYL-D-GLUCOSAMINE, 2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE
Authors:Kumar, J., Sharma, S., Jasti, J., Bhushan, A., Singh, T.P.
Deposit date:2003-03-29
Release date:2004-05-18
Last modified:2018-07-25
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of a 40 kDa signalling protein (SPC-40) secreted during involution
To be Published
1MH7
  • Download 1mh7
  • View 1mh7
Molmil generated image of 1mh7
CRYSTAL STRUCTURE OF A CALCIUM-FREE ISOFORM OF PHOSPHOLIPASE A2 FROM NAJA NAJA SAGITTIFERA AT 2.0 A RESOLUTION
Descriptor:PHOSPHOLIPASE A2
Authors:Jabeen, T., Jasti, J., Singh, R.K., Sujata, S., Singh, T.P.
Deposit date:2002-08-19
Release date:2003-05-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of a Calcium-Free Isoform of Phospholipase A2 from Naja naja sagittifera at 2.0 A Resolution
To be Published
1MH8
  • Download 1mh8
  • View 1mh8
Molmil generated image of 1mh8
CRYSTAL STRUCTURE OF A PHOPHOLIPASE A2 MONOMER WITH ISOLEUCINE AT SECOND POSITION
Descriptor:PHOSPHOLIPASE A2
Authors:Jabeen, T., Jasti, J., Singh, N., Singh, R.K., Sharma, S., Singh, T.P.
Deposit date:2002-08-19
Release date:2003-06-10
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Crystal Structure of a Phospholipase A2 Monomer with Isoleucine at Second Position
To be Published
1OWS
  • Download 1ows
  • View 1ows
Molmil generated image of 1ows
CRYSTAL STRUCTURE OF A C49 PHOSPHOLIPASE A2 FROM INDIAN COBRA REVEALS CARBOHYDRATE BINDING IN THE HYDROPHOBIC CHANNEL
Descriptor:Phospholipase A2, N-ACETYL-D-GLUCOSAMINE, ZINC ION
Authors:Jabeen, T., Jasti, J., Singh, N., Singh, R.K., Sharma, S., Kaur, P., Singh, T.P.
Deposit date:2003-03-30
Release date:2003-05-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a C49 Phospholipase A2 from Indian cobra reveals carbohydrate binding in the hydrophobic channel
To be Published
1TC8
  • Download 1tc8
  • View 1tc8
Molmil generated image of 1tc8
CRYSTAL STRUCTURE OF KRAIT-VENOM PHOSPHOLIPASE A2 IN A COMPLEX WITH A NATURAL FATTY ACID TRIDECANOIC ACID
Descriptor:phospholipase A2 isoform 1, SODIUM ION, N-TRIDECANOIC ACID
Authors:Singh, G., Jasti, J., Saravanan, K., Sharma, S., Kaur, P., Srinivasan, A., Singh, T.P.
Deposit date:2004-05-21
Release date:2004-06-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystal structure of the complex formed between a group I phospholipase A2 and a naturally occurring fatty acid at 2.7 A resolution
PROTEIN SCI., 14, 2005
1Y75
  • Download 1y75
  • View 1y75
Molmil generated image of 1y75
A NEW FORM OF CATALYTICALLY INACTIVE PHOSPHOLIPASE A2 WITH AN UNUSUAL DISULPHIDE BRIDGE CYS 32- CYS 49 REVEALS RECOGNITION FOR N-ACETYLGLUCOSMINE
Descriptor:phospholipase A2 isoform 5, phospholipase A2 isoform 6, N-ACETYL-D-GLUCOSAMINE, ...
Authors:Jabeen, T., Singh, N., Jasti, J., Singh, R.K., Sharma, S., Perbandt, M., Betzel, C., Kaur, P., Srinivasan, A., Singh, T.P.
Deposit date:2004-12-08
Release date:2005-05-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a heterodimer of phospholipase A2 from Naja naja sagittifera at 2.3 A resolution reveals the presence of a new PLA2-like protein with a novel cys 32-Cys 49 disulphide bridge with a bound sugar at the substrate-binding site
Proteins, 62, 2006
2I3V
  • Download 2i3v
  • View 2i3v
Molmil generated image of 2i3v
MEASUREMENT OF CONFORMATIONAL CHANGES ACCOMPANYING DESENSITIZATION IN AN IONOTROPIC GLUTAMATE RECEPTOR: STRUCTURE OF G725C MUTANT
Descriptor:Glutamate receptor 2, ZINC ION, GLUTAMIC ACID
Authors:Armstrong, N., Jasti, J., Beich-Frandsen, M., Gouaux, E.
Deposit date:2006-08-21
Release date:2006-10-17
Last modified:2017-08-16
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Measurement of Conformational Changes accompanying Desensitization in an Ionotropic Glutamate Receptor.
Cell(Cambridge,Mass.), 127, 2006
2I3W
  • Download 2i3w
  • View 2i3w
Molmil generated image of 2i3w
MEASUREMENT OF CONFORMATIONAL CHANGES ACCOMPANYING DESENSITIZATION IN AN IONOTROPIC GLUTAMATE RECEPTOR: STRUCTURE OF S729C MUTANT
Descriptor:GLUTAMATE RECEPTOR SUBUNIT 2, GLUTAMIC ACID
Authors:Armstrong, N., Jasti, J., Beich-Frandsen, M., Gouaux, E.
Deposit date:2006-08-21
Release date:2006-10-17
Last modified:2017-08-16
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Measurement of Conformational Changes accompanying Desensitization in an Ionotropic Glutamate Receptor.
Cell(Cambridge,Mass.), 127, 2006
1FB2
  • Download 1fb2
  • View 1fb2
Molmil generated image of 1fb2
STRUCTURE OF PHOSPHOLIPASE A2 FROM DABOIA RUSSELLI PULCHELLA AT 1.95
Descriptor:PHOSPHOLIPASE A2
Authors:Chandra, V., Kaur, P., Betzel, C., Singh, T.P.
Deposit date:2000-07-14
Release date:2001-07-25
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Regulation of catalytic function by molecular association: structure of phospholipase A2 from Daboia russelli pulchella (DPLA2) at 1.9 A resolution.
Acta Crystallogr.,Sect.D, 57, 2001
5VET
  • Download 5vet
  • View 5vet
Molmil generated image of 5vet
PHOSPHOLIPASE A2, RE-REFINEMENT OF THE PDB STRUCTURE 1JQ8 WITHOUT THE PUTATIVE COMPLEXED OLIGOPEPTIDE
Descriptor:Phospholipase A2 VRV-PL-VIIIa
Authors:Wlodawer, A., Dauter, Z., Minor, W., Stanfield, R., Porebski, P., Jaskolski, M., Pozharski, E., Weichenberger, C.X., Rupp, B.
Deposit date:2017-04-05
Release date:2018-06-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Detect, correct, retract: How to manage incorrect structural models.
FEBS J., 285, 2018
1OXL
  • Download 1oxl
  • View 1oxl
Molmil generated image of 1oxl
INHIBITION OF PHOSPHOLIPASE A2 (PLA2) BY (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-INDOL-7-YL)-ACETIC ACID (INDOLE): CRYSTAL STRUCTURE OF THE COMPLEX FORMED BETWEEN PLA2 FROM RUSSELL'S VIPER AND INDOLE AT 1.8 RESOLUTION
Descriptor:Phospholipase A2 VRV-PL-VIIIa, (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-INDOL-7-YL)ACETIC ACID, CARBONATE ION, ...
Authors:Chandra, V., Balasubramanya, R., Kaur, P., Singh, T.P.
Deposit date:2003-04-02
Release date:2004-04-06
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of the complex of the secretory phospholipase A2 from Daboia russelli pulchella with an endogenic indole derivative, 2-carbamoylmethyl-5-propyl-octahydro-indol-7-yl-acetic acid at 1.8 A resolution.
Biochim.Biophys.Acta, 1752, 2005
1Z5G
  • Download 1z5g
  • View 1z5g
Molmil generated image of 1z5g
CRYSTAL STRUCTURE OF SALMONELLA TYPHIMURIUM APHA PROTEIN
Descriptor:AphA protein, MAGNESIUM ION, PHOSPHATE ION
Authors:Makde, R.D., Kumar, V.
Deposit date:2005-03-18
Release date:2006-03-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and mutational analyses reveal the functional role of active-site Lys-154 and Asp-173 of Salmonella typhimurium AphA protein.
Arch.Biochem.Biophys., 464, 2007
<12>