Author results

4RA1
  • Download 4ra1
  • View 4ra1
Molmil generated image of 4ra1
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH D-GLUCOSE-2-PHOSPHATE
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), 2-O-phosphono-alpha-D-glucopyranose, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2014-09-09
Release date:2015-08-19
Last modified:2015-09-02
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZA6
  • Download 4za6
  • View 4za6
Molmil generated image of 4za6
STRUCTURE OF THE R. ERYTHROPOLIS TRANSCRIPTIONAL REPRESSOR QSDR FROM TETR FAMILY
Descriptor:TetR family transcriptional regulator, (4S)-2-METHYL-2,4-PENTANEDIOL, ACETATE ION, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-13
Release date:2015-10-21
Last modified:2015-11-25
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Natural Guided Genome Engineering Reveals Transcriptional Regulators Controlling Quorum-Sensing Signal Degradation.
Plos One, 10, 2015
4ZE8
  • Download 4ze8
  • View 4ze8
Molmil generated image of 4ze8
PBP ACCA FROM A. TUMEFACIENS C58
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), SULFATE ION, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZE9
  • Download 4ze9
  • View 4ze9
Molmil generated image of 4ze9
SE-PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH AGROCINOPINE A
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), [(2R,3S,4S,5S)-2,5-bis(hydroxymethyl)-5-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxolan-3-yl] [(2R,3R,4S,5S)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate
Authors:El Sahili, A., Guimaraes, B.G., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZEB
  • Download 4zeb
  • View 4zeb
Molmil generated image of 4zeb
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH AGROCINOPINE A
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), [(2R,3S,4S,5S)-2,5-bis(hydroxymethyl)-5-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxolan-3-yl] [(2R,3R,4S,5S)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZEC
  • Download 4zec
  • View 4zec
Molmil generated image of 4zec
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH AGROCIN 84
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), [(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]oxy-N-[9-[(2R,3S,5R)-5-[[[(2R,3S)-4-methyl-2,3-bis(oxidanyl)pentanoyl]amino]-oxidanyl-phosphoryl]oxy-3-oxidanyl-oxolan-2-yl]purin-6-yl]phosphonamidic acid, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZED
  • Download 4zed
  • View 4zed
Molmil generated image of 4zed
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH AGROCINOPINE-3'-O-BENZOATE
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), [(2S,3S,4R,5R)-2,5-bis(hydroxymethyl)-2-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-[oxidanyl-[(2R,3R,4S,5S)-2,4,5-tris(oxidanyl)oxan-3-yl]oxy-phosphoryl]oxy-oxolan-3-yl] benzoate, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZEI
  • Download 4zei
  • View 4zei
Molmil generated image of 4zei
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH L-ARABINOSE-2-PHOSPHATE
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), 2-O-phosphono-alpha-L-arabinopyranose, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
4ZEK
  • Download 4zek
  • View 4zek
Molmil generated image of 4zek
PBP ACCA FROM A. TUMEFACIENS C58 IN COMPLEX WITH L-ARABINOSE-2-ISOPROPYLPHOSPHATE
Descriptor:ABC TRANSPORTER, SUBSTRATE BINDING PROTEIN (AGROCINOPINES A AND B), 2-O-[(R)-hydroxy(propan-2-yloxy)phosphoryl]-alpha-L-arabinopyranose, ...
Authors:El Sahili, A., Morera, S.
Deposit date:2015-04-20
Release date:2015-08-19
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:A Pyranose-2-Phosphate Motif Is Responsible for Both Antibiotic Import and Quorum-Sensing Regulation in Agrobacterium tumefaciens.
Plos Pathog., 11, 2015
5XVU
  • Download 5xvu
  • View 5xvu
Molmil generated image of 5xvu
CRYSTAL STRUCTURE OF THE PROTEIN KINASE CK2 CATALYTIC DOMAIN FROM PLASMODIUM FALCIPARUM BOUND TO ATP
Descriptor:Casein kinase 2, alpha subunit, SULFATE ION, ...
Authors:El Sahili, A., Lescar, J., Ruiz-Carrillo, D., Lin, J.
Deposit date:2017-06-28
Release date:2017-07-12
Last modified:2019-01-23
Method:X-RAY DIFFRACTION (3 Å)
Cite:The protein kinase CK2 catalytic domain from Plasmodium falciparum: crystal structure, tyrosine kinase activity and inhibition.
Sci Rep, 8, 2018
6I7W
  • Download 6i7w
  • View 6i7w
Molmil generated image of 6i7w
STRUCTURE OF THE PERIPLASMIC BINDING PROTEIN (PBP) ACCA IN COMPLEX WITH 2-GLUCOSE-2-O-LACTIC ACID PHOSPHATE (G2LP) FROM AGROBACTERIUM FABRUM C58
Descriptor:ABC transporter, substrate binding protein (Agrocinopines A and B), [(2~{S})-1,1-bis(oxidanyl)propan-2-yl] [(2~{R},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate, ...
Authors:Morera, S., Vigouroux, A., El Sahili, A.
Deposit date:2018-11-19
Release date:2019-01-23
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Synthesis of a non-natural glucose-2-phosphate ester able to dupe the acc system of Agrobacterium fabrum.
Org. Biomol. Chem., 17, 2019
5FSW
  • Download 5fsw
  • View 5fsw
Molmil generated image of 5fsw
RNA DEPENDENT RNA POLYMERASE QDE-1 FROM THIELAVIA TERRESTRIS
Descriptor:RNA DEPENDENT RNA POLYMERASE QDE-1
Authors:Qian, X., Hamid, F.M., El Sahili, A., Darwis, D.A., Wong, Y.H., Bhushan, S., Makeyev, E.V., Lescar, J.
Deposit date:2016-01-08
Release date:2016-03-02
Last modified:2016-05-11
Method:X-RAY DIFFRACTION (3.19 Å)
Cite:Functional Evolution in Orthologous Cell-Encoded RNA-Dependent RNA Polymerases
J.Biol.Chem., 291, 2016
5JJR
  • Download 5jjr
  • View 5jjr
Molmil generated image of 5jjr
DENGUE 3 NS5 PROTEIN WITH COMPOUND 29
Descriptor:Genome polyprotein, ZINC ION, S-ADENOSYL-L-HOMOCYSTEINE, ...
Authors:Lescar, J., El Sahili, A.
Deposit date:2016-04-25
Release date:2016-07-06
Last modified:2016-08-24
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Potent Allosteric Dengue Virus NS5 Polymerase Inhibitors: Mechanism of Action and Resistance Profiling
Plos Pathog., 12, 2016
5JJS
  • Download 5jjs
  • View 5jjs
Molmil generated image of 5jjs
DENGUE 3 NS5 PROTEIN WITH COMPOUND 27
Descriptor:Genome polyprotein, ZINC ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Lescar, J., El Sahili, A.
Deposit date:2016-04-25
Release date:2016-07-06
Last modified:2016-08-24
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Potent Allosteric Dengue Virus NS5 Polymerase Inhibitors: Mechanism of Action and Resistance Profiling
Plos Pathog., 12, 2016
5YVU
  • Download 5yvu
  • View 5yvu
Molmil generated image of 5yvu
CRYSTAL STRUCTURES OF UNLINKED FULL LENGTH NS3 FROM DENGUE VIRUS PROVIDE INSIGHTS INTO DYNAMICS OF PROTEASE DOMAIN
Descriptor:Genome polyprotein, Pancreatic trypsin inhibitor, GLYCEROL
Authors:Phoo, W.W., El Sahili, A.
Deposit date:2017-11-27
Release date:2018-11-28
Method:X-RAY DIFFRACTION (2.491 Å)
Cite:Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
To Be Published
5YVW
  • Download 5yvw
  • View 5yvw
Molmil generated image of 5yvw
CRYSTAL STRUCTURE OF FULL LENGTH NS3 PROTEIN (ED4NS2BNS3) FROM DENV4 IN CLOSED CONFORMATION
Descriptor:Genome polyprotein, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
Authors:PHOO, W.W., El Sahili, A.
Deposit date:2017-11-27
Release date:2018-12-05
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
To Be Published
5WRP
  • Download 5wrp
  • View 5wrp
Molmil generated image of 5wrp
T-STATE CRYSTAL STRUCTURE OF PYRUVATE KINASE FROM MYCOBACTERIUM TUBERCULOSIS
Descriptor:Pyruvate kinase, PHOSPHATE ION
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-02
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5WS8
  • Download 5ws8
  • View 5ws8
Molmil generated image of 5ws8
PYRUVATE KINASE (PYK) FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH OXALATE
Descriptor:Pyruvate kinase, MAGNESIUM ION, OXALATE ION
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-06
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5WS9
  • Download 5ws9
  • View 5ws9
Molmil generated image of 5ws9
PYRUVATE KINASE (PYK) FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH OXALATE, ATP AND ALLOSTERIC ACTIVATOR AMP
Descriptor:Pyruvate kinase, MAGNESIUM ION, OXALATE ION, ...
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-06
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5WSA
  • Download 5wsa
  • View 5wsa
Molmil generated image of 5wsa
PYRUVATE KINASE (PYK) FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH OXALATE AND ALLOSTERIC ACTIVATOR GLUCOSE 6-PHOSPHATE
Descriptor:Pyruvate kinase, ALPHA-D-GLUCOSE-6-PHOSPHATE, MAGNESIUM ION, ...
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-06
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5WSB
  • Download 5wsb
  • View 5wsb
Molmil generated image of 5wsb
PYRUVATE KINASE (PYK) FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH OXALATE, ALLOSTERIC ACTIVATORS AMP AND GLUCOSE 6-PHOSPHATE
Descriptor:Pyruvate kinase, ADENOSINE MONOPHOSPHATE, ALPHA-D-GLUCOSE-6-PHOSPHATE, ...
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-06
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5WSC
  • Download 5wsc
  • View 5wsc
Molmil generated image of 5wsc
CRYSTAL OF PYRUVATE KINASE (PYK) FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH OXALATE, SOAKED WITH ALLOSTERIC ACTIVATORS AMP AND GLUCOSE 6-PHOSPHATE
Descriptor:Pyruvate kinase, ADENOSINE MONOPHOSPHATE, ALPHA-D-GLUCOSE-6-PHOSPHATE, ...
Authors:Zhong, W., Cai, Q., El Sahili, A., Lescar, J., Dedon, P.C.
Deposit date:2016-12-06
Release date:2017-11-15
Last modified:2018-01-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Allosteric pyruvate kinase-based "logic gate" synergistically senses energy and sugar levels in Mycobacterium tuberculosis.
Nat Commun, 8, 2017
5YVJ
  • Download 5yvj
  • View 5yvj
Molmil generated image of 5yvj
CRYSTAL STRUCTURE OF FULL LENGTH NS2B47-NS3 (GD4NS2BNS3) FROM DENGUE VIRUS 4 IN OPEN CONFORMATION
Descriptor:Genome polyprotein, GLYCEROL
Authors:Phoo, W.W., El Sahili, A.
Deposit date:2017-11-26
Release date:2018-11-28
Method:X-RAY DIFFRACTION (2.508 Å)
Cite:Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
To Be Published
5YVY
  • Download 5yvy
  • View 5yvy
Molmil generated image of 5yvy
CRYSTAL STRUCTURE OF UNLINKED FULL LENGTH NS3 PROTEIN (ED4NS2BNS3) FROM DENV4 IN CLOSED CONFORMATION
Descriptor:Genome polyprotein
Authors:PHOO, W.W., El Sahili, A.
Deposit date:2017-11-27
Release date:2018-11-28
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
To Be Published
5YW1
  • Download 5yw1
  • View 5yw1
Molmil generated image of 5yw1
CRYSTAL STRUCTURE OF FULL LENGTH NS3 PROTEIN (ED4NS2BNS3) IN COMPLEX WITH BOVINE PANCREATIC TRYPSIN INHIBITOR
Descriptor:Peptidase S7, FLAVIVIRUS_NS2B, PTI protein
Authors:Phoo, W.W., El Sahili, A.
Deposit date:2017-11-28
Release date:2019-01-02
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
To Be Published
<12>