Author results

6OE3
  • Download 6oe3
  • View 6oe3
Molmil generated image of 6oe3
CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE IN COMPLEX WITH 5-(2-(2-(2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)ETHOXY)PHENOXY)-7-FLUORO-2-NAPHTHONITRILE (JLJ635), A NON-NUCLEOSIDE INHIBITOR
分子名称:HIV-1 REVERSE TRANSCRIPTASE, P66 SUBUNIT, P51 SUBUNIT, ...
著者Bertoletti, N., Kudalkar, S.N., Anderson, K.S., Cisneros Trigo, J.A., Jorgensen, W.L.
登録日2019-03-27
公開日2019-05-15
最終更新日2019-05-22
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Structural and pharmacological evaluation of a novel non-nucleoside reverse transcriptase inhibitor as a promising long acting nanoformulation for treating HIV.
Antiviral Res., 167, 2019
6MB4
  • Download 6mb4
  • View 6mb4
Molmil generated image of 6mb4
BINARY (SISOMICIN) STRUCTURE OF AAC-IIIB
分子名称:Aac(3)-IIIb protein, (1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-hydroxycyclohexyl 3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranoside
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (2.302 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6MB5
  • Download 6mb5
  • View 6mb5
Molmil generated image of 6mb5
AAC-IIIB BINARY WITH NEOMYCIN
分子名称:Aac(3)-IIIb protein, NEOMYCIN
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6MB6
  • Download 6mb6
  • View 6mb6
Molmil generated image of 6mb6
AAC-IIIB BINARY WITH COASH
分子名称:Aac(3)-IIIb protein, COENZYME A, MALONATE ION
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6MB7
  • Download 6mb7
  • View 6mb7
Molmil generated image of 6mb7
BINARY (PAROMOMYCIN) STRUCTURE OF AAC-IIIB
分子名称:Aac(3)-IIIb protein, PAROMOMYCIN
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6MB8
  • Download 6mb8
  • View 6mb8
Molmil generated image of 6mb8
APO STRUCTURE OF AAC-IIIB
分子名称:Aac(3)-IIIb protein, CHLORIDE ION
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6MB9
  • Download 6mb9
  • View 6mb9
Molmil generated image of 6mb9
TERNARY (NEOMYCIN/COA) STRUCTURE OF AAC-IIIB
分子名称:Aac(3)-IIIb protein, COENZYME A, NONAETHYLENE GLYCOL, ...
著者Cuneo, M.J., Kumar, P.
登録日2018-08-29
公開日2018-11-07
最終更新日2018-12-05
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Encoding of Promiscuity in an Aminoglycoside Acetyltransferase.
J. Med. Chem., 61, 2018
6AAL
  • Download 6aal
  • View 6aal
Molmil generated image of 6aal
CRYSTAL STRUCTURE OF PUTATIVE AMINO ACID BINDING PERIPLASMIC ABC TRANSPORTER PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS IN COMPLEX WITH ARGININE
分子名称:Putative amino acid-binding periplasmic ABC transporter protein, 1,2-ETHANEDIOL, SULFATE ION, ...
著者Kumar, P., Kesari, P., Ghosh, D.K., Kumar, P., Sharma, A.K.
登録日2018-07-18
公開日2019-06-12
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structures of a putative periplasmic cystine-binding protein from Candidatus Liberibacter asiaticus: insights into an adapted mechanism of ligand binding.
Febs J., 2019
6AA1
  • Download 6aa1
  • View 6aa1
Molmil generated image of 6aa1
CRYSTAL STRUCTURE OF PUTATIVE AMINO ACID BINDING PERIPLASMIC ABC TRANSPORTER PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS BOUND WITH CITRATE
分子名称:Putative amino acid-binding periplasmic ABC transporter protein, GLYCEROL, 1,2-ETHANEDIOL, ...
著者Kumar, P., Kesari, P., Ghosh, D.K., Kumar, P., Sharma, A.K.
登録日2018-07-16
公開日2019-06-12
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Crystal structures of a putative periplasmic cystine-binding protein from Candidatus Liberibacter asiaticus: insights into an adapted mechanism of ligand binding.
Febs J., 2019
6A8S
  • Download 6a8s
  • View 6a8s
Molmil generated image of 6a8s
CRYSTAL STRUCTURE OF THE PUTATIVE AMINO ACID-BINDING PERIPLASMIC ABC TRANSPORTER PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS IN COMPLEX WITH CYSTEINE
分子名称:Putative amino acid-binding periplasmic ABC transporter protein, SULFATE ION, 1,2-ETHANEDIOL, ...
著者Kumar, P., Kesari, P., Ghosh, D.K., Kumar, P., Sharma, A.K.
登録日2018-07-10
公開日2019-06-12
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal structures of a putative periplasmic cystine-binding protein from Candidatus Liberibacter asiaticus: insights into an adapted mechanism of ligand binding.
Febs J., 2019
6A80
  • Download 6a80
  • View 6a80
Molmil generated image of 6a80
CRYSTAL STRUCTURE OF PUTATIVE AMINO ACID BINDING PERIPLASMIC ABC TRANSPORTER PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS IN COMPLEX WITH CYSTINE
分子名称:Putative amino acid-binding periplasmic ABC transporter protein, 1,2-ETHANEDIOL, GLYCEROL, ...
著者Kumar, P., Kesari, P., Ghosh, D.K., Kumar, P., Sharma, A.K.
登録日2018-07-05
公開日2019-06-12
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Crystal structures of a putative periplasmic cystine-binding protein from Candidatus Liberibacter asiaticus: insights into an adapted mechanism of ligand binding.
Febs J., 2019
6DGB
  • Download 6dgb
  • View 6dgb
Molmil generated image of 6dgb
CRYSTAL STRUCTURE OF THE C-TERMINAL CATALYTIC DOMAIN OF IS1535 TNPA, AN IS607-LIKE SERINE RECOMBINASE
分子名称:IS607 family transposase IS1535
著者Chen, W.Y., Hancock, S.P., Cascio, D., Johnson, R.C.
登録日2018-05-17
公開日2018-07-18
最終更新日2019-04-03
実験手法X-RAY DIFFRACTION (2.52 Å)
主引用文献Multiple serine transposase dimers assemble the transposon-end synaptic complex during IS607-family transposition.
Elife, 7, 2018
6DGC
  • Download 6dgc
  • View 6dgc
Molmil generated image of 6dgc
CRYSTAL STRUCTURE OF THE C-TERMINAL CATALYTIC DOMAIN OF ISC1926 TNPA, AN IS607-LIKE SERINE RECOMBINASE
分子名称:ISC1926 TnpA C-terminal catalytic domain
著者Hancock, S.P., Kumar, P., Cascio, D., Johnson, R.C.
登録日2018-05-17
公開日2018-07-18
最終更新日2019-04-03
実験手法X-RAY DIFFRACTION (2.92 Å)
主引用文献Multiple serine transposase dimers assemble the transposon-end synaptic complex during IS607-family transposition.
Elife, 7, 2018
5ZH8
  • Download 5zh8
  • View 5zh8
Molmil generated image of 5zh8
CRYSTAL STRUCTURE OF FMTA FROM STAPHYLOCOCCUS AUREUS AT 2.58 A
分子名称:Protein FmtA, GLYCEROL
著者Dalal, V., Kumar, P., Golemi-Kotra, D., Kumar, P.
登録日2018-03-12
公開日2019-07-17
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Repurposing an Ancient Protein Core Structure: Structural Studies on FmtA, a Novel Esterase of Staphylococcus aureus.
J.Mol.Biol., 2019
5ZHA
  • Download 5zha
  • View 5zha
Molmil generated image of 5zha
STRUCTURE OF Y68F MUTANT MN-BOUND PERIPLASMIC METAL BINDING PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS
分子名称:Periplasmic solute binding protein, MANGANESE (II) ION, GLYCEROL, ...
著者Saini, G., Sharma, N., Dalal, V., Kumar, P., Sharma, A.K.
登録日2018-03-12
公開日2018-10-03
最終更新日2018-10-10
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献The analysis of subtle internal communications through mutation studies in periplasmic metal uptake protein CLas-ZnuA2
J. Struct. Biol., 204, 2018
6CHW
  • Download 6chw
  • View 6chw
Molmil generated image of 6chw
ESTROGEN RECEPTOR ALPHA Y537S COVALENTLY BOUND TO ANTAGONIST H3B-5942.
分子名称:Estrogen receptor, 4-[(2-{4-[(1E)-1-(1H-indazol-5-yl)-2-phenylbut-1-en-1-yl]phenoxy}ethyl)amino]-N,N-dimethylbutanamide, 1,2-ETHANEDIOL, ...
著者Larsen, N.A.
登録日2018-02-23
公開日2018-03-21
最終更新日2018-09-12
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Discovery of Selective Estrogen Receptor Covalent Antagonists for the Treatment of ER alphaWTand ER alphaMUTBreast Cancer.
Cancer Discov, 8, 2018
6CHZ
  • Download 6chz
  • View 6chz
Molmil generated image of 6chz
ESTROGEN RECEPTOR ALPHA Y537S BOUND TO ANTAGONIST H3B-9224.
分子名称:Estrogen receptor, 4-[(2-{4-[(1E)-1-(1H-indazol-5-yl)-2-phenylbut-1-en-1-yl]phenoxy}ethyl)amino]-N,N-dimethylbutanamide, 1,2-ETHANEDIOL
著者Larsen, N.A.
登録日2018-02-23
公開日2018-03-21
最終更新日2018-09-12
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Discovery of Selective Estrogen Receptor Covalent Antagonists for the Treatment of ER alphaWTand ER alphaMUTBreast Cancer.
Cancer Discov, 8, 2018
5Z35
  • Download 5z35
  • View 5z35
Molmil generated image of 5z35
STRUCTURE OF Y68F MUTANT METAL FREE PERIPLASMIC METAL BINDING PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS
分子名称:Periplasmic solute binding protein, ACETATE ION, SULFATE ION, ...
著者Saini, G., Sharma, N., Dalal, V., Kumar, P., Sharma, A.K.
登録日2018-01-05
公開日2018-10-03
最終更新日2018-10-10
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The analysis of subtle internal communications through mutation studies in periplasmic metal uptake protein CLas-ZnuA2
J. Struct. Biol., 204, 2018
5Z2J
  • Download 5z2j
  • View 5z2j
Molmil generated image of 5z2j
STRUCTURE OF S38A MUTANT METAL-FREE PERIPLASMIC METAL BINDING PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS
分子名称:Periplasmic solute binding protein, ACETATE ION, SULFATE ION, ...
著者Saini, G., Sharma, N., Dalal, V., Kumar, P., Sharma, A.K.
登録日2018-01-02
公開日2018-10-03
最終更新日2018-10-10
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献The analysis of subtle internal communications through mutation studies in periplasmic metal uptake protein CLas-ZnuA2
J. Struct. Biol., 204, 2018
5Z2K
  • Download 5z2k
  • View 5z2k
Molmil generated image of 5z2k
STRUCTURE OF S38A MUTANT MN-BOUND PERIPLASMIC METAL BINDING PROTEIN FROM CANDIDATUS LIBERIBACTER ASIATICUS
分子名称:Periplasmic solute binding protein, MANGANESE (II) ION, SULFATE ION, ...
著者Saini, G., Sharma, N., Dalal, V., Kumar, P., Sharma, A.K.
登録日2018-01-02
公開日2018-10-03
最終更新日2018-10-10
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The analysis of subtle internal communications through mutation studies in periplasmic metal uptake protein CLas-ZnuA2
J. Struct. Biol., 204, 2018
6BOI
  • Download 6boi
  • View 6boi
Molmil generated image of 6boi
CRYSTAL STRUCTURE OF LDTMT2 (56-408) WITH A PANIPENEM ADDUCT AT THE ACTIVE SITE CYSTEINE-354
分子名称:Putative conserved lipoprotein LppS, (3S,5R)-5-[(2R,3R)-1,3-dihydroxybutan-2-yl]-3-({(3R)-1-[(1E)-ethanimidoyl]pyrrolidin-3-yl}sulfanyl)-L-proline, DI(HYDROXYETHYL)ETHER, ...
著者Saavedra, H., Bianchet, M.A.
登録日2017-11-20
公開日2018-04-11
実験手法X-RAY DIFFRACTION (2.102 Å)
主引用文献Structures and Mechanism of Inhibition of Mycobacterium tuberculosis L,D-transpeptidase 2 by Panipenem
To Be Published
6BML
  • Download 6bml
  • View 6bml
Molmil generated image of 6bml
STRUCTURE OF HUMAN DHHC20 PALMITOYLTRANSFERASE, IRREVERSIBLY INHIBITED BY 2-BROMOPALMITATE
分子名称:human DHHC20 palmitoyltransferase, ZINC ION, PALMITIC ACID, ...
著者Rana, M.S., Lee, C.-J., Banerjee, A.
登録日2017-11-15
公開日2018-01-24
最終更新日2018-03-28
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Fatty acyl recognition and transfer by an integral membraneS-acyltransferase.
Science, 359, 2018
6BMM
  • Download 6bmm
  • View 6bmm
Molmil generated image of 6bmm
STRUCTURE OF HUMAN DHHC20 PALMITOYLTRANSFERASE, SPACE GROUP P21
分子名称:human DHHC20 palmitoyltransferase, ZINC ION, PHOSPHATE ION, ...
著者Rana, M.S., Lee, C.-J., Banerjee, A.
登録日2017-11-15
公開日2018-01-24
最終更新日2018-03-28
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Fatty acyl recognition and transfer by an integral membraneS-acyltransferase.
Science, 359, 2018
6BMN
  • Download 6bmn
  • View 6bmn
Molmil generated image of 6bmn
STRUCTURE OF HUMAN DHHC20 PALMITOYLTRANSFERASE, SPACE GROUP P63
分子名称:human DHHC20 palmitoyltransferase, ZINC ION, PHOSPHATE ION, ...
著者Rana, M.S., Lee, C.-J., Banerjee, A.
登録日2017-11-15
公開日2018-01-24
最終更新日2018-03-28
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Fatty acyl recognition and transfer by an integral membraneS-acyltransferase.
Science, 359, 2018
6BMS
  • Download 6bms
  • View 6bms
Molmil generated image of 6bms
PALMITOYLTRANSFERASE STRUCTURE
分子名称:Palmitoyltransferase, ZINC ION, DODECYL-BETA-D-MALTOSIDE, ...
著者Kumar, P., Rajashankar, K.
登録日2017-11-15
公開日2018-01-10
最終更新日2018-03-28
実験手法X-RAY DIFFRACTION (2.441 Å)
主引用文献Fatty acyl recognition and transfer by an integral membraneS-acyltransferase.
Science, 359, 2018