Author results

3SXW
  • Download 3sxw
  • View 3sxw
Molmil generated image of 3sxw
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR69.
Descriptor:Glucose-6-phosphate isomerase
Authors:Vorobiev, S., Su, M., Nivon, L., Seetharaman, J., Patel, P., Xiao, R., Maglaqui, M., Ciccosanti, C., Baker, D., Everett, J.K., Nair, R., Acton, T.B., Rost, B., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-07-15
Release date:2011-08-03
Method:X-RAY DIFFRACTION (1.801 Å)
Cite:Crystal Structure of Engineered Protein. Northeast Structural Genomics Consortium Target OR69.
To be Published
3SY1
  • Download 3sy1
  • View 3sy1
Molmil generated image of 3sy1
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR70
Descriptor:UPF0001 protein yggS, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ACETIC ACID
Authors:Vorobiev, S., Su, M., Nivon, L., Seetharaman, J., Sahdev, S., Xiao, R., Ciccosanti, C., Maglaqui, M., Baker, D., Everett, J.K., Nair, R., Acton, T.B., Rost, B., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-07-15
Release date:2011-08-03
Method:X-RAY DIFFRACTION (1.465 Å)
Cite:Crystal Structure of Engineered Protein. Northeast Structural Genomics Consortium Target OR70
To be Published
3TP4
  • Download 3tp4
  • View 3tp4
Molmil generated image of 3tp4
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN AT THE RESOLUTION 1.98A, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR128
Descriptor:computational Design of Enzyme, ACETIC ACID, MAGNESIUM ION, ...
Authors:Kuzin, A., Su, M., Seetharaman, J., Rajagopalan, S., Everett, J.K., Nair, R., Acton, T.B., Rost, B., Baker, D., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-09-07
Release date:2011-10-05
Last modified:2014-05-14
Method:X-RAY DIFFRACTION (1.979 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
3U19
  • Download 3u19
  • View 3u19
Molmil generated image of 3u19
CRYSTAL STRUCTURE OF ACYLENZYME INTERMEDIATE OF DE NOVO DESIGNED CYSTEINE ESTERASE ECH13, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR51
Descriptor:artificial protein OR51, GLYCEROL
Authors:Kuzin, A., Su, M., Seetharaman, J., Sahdev, S., Xiao, R., Kohan, E., Richter, F., Everett, J.K., Acton, T.B., Baker, D., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-09-29
Release date:2011-10-26
Method:X-RAY DIFFRACTION (2 Å)
Cite:CRYSTAL STRUCTURE OF ACYLENZYME INTERMEDIATE OF DE NOVO DESIGNED CYSTEINE ESTERASE ECH13, Northeast Structural Genomics Consortium Target OR51
To be Published
3UW6
  • Download 3uw6
  • View 3uw6
Molmil generated image of 3uw6
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR120
Descriptor:Alanine racemase
Authors:Seetharaman, J., Lew, S., Nivon, L., Baker, D., Bjelic, S., Ciccosanti, C., Sahdev, S., Xiao, R., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-11-30
Release date:2012-02-08
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Structure of Engineered Protein, Northeast Structural Genomics Consortium Target OR120
TO BE PUBLISHED
3V45
  • Download 3v45
  • View 3v45
Molmil generated image of 3v45
CRYSTAL STRUCTURE OF DE NOVO DESIGNED SERINE HYDROLASE OSH55, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR130
Descriptor:Serine hydrolase OSH55, CHLORIDE ION, SODIUM ION
Authors:Kuzin, A., Su, M., Seetharaman, J., Maglaqui, M., Xiao, R., Kohan, E., Rajagopalan, S., Everett, J.K., Nair, R., Acton, T.B., Rost, B., Baker, D., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-12-14
Release date:2012-01-04
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
3VB8
  • Download 3vb8
  • View 3vb8
Molmil generated image of 3vb8
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR43
Descriptor:Engineered protein, SULFATE ION
Authors:Seetharaman, J., Su, M., Procko, E., Baker, D., Ciccosanti, C., Sahdev, S., Xiao, R., Everett, J.K., Acton, T.B., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2011-12-31
Release date:2012-06-06
Last modified:2013-09-11
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Computational design of a protein-based enzyme inhibitor.
J.Mol.Biol., 425, 2013
3VCD
  • Download 3vcd
  • View 3vcd
Molmil generated image of 3vcd
COMPUTATIONALLY DESIGNED SELF-ASSEMBLING OCTAHEDRAL CAGE PROTEIN, O333, CRYSTALLIZED IN SPACE GROUP R32
Descriptor:Propanediol utilization polyhedral body protein PduT, SULFATE ION, CHLORIDE ION
Authors:Sawaya, M.R., King, N.P., Sheffler, W., Baker, D., Yeates, T.O.
Deposit date:2012-01-03
Release date:2012-06-06
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Computational design of self-assembling protein nanomaterials with atomic level accuracy.
Science, 336, 2012
4D49
  • Download 4d49
  • View 4d49
Molmil generated image of 4d49
CRYSTAL STRUCTURE OF COMPUTATIONALLY DESIGNED ARMADILLO REPEAT PROTEINS FOR MODULAR PEPTIDE RECOGNITION.
Descriptor:ARMADILLO REPEAT PROTEIN ARM00027, POLY ARG DECAPEPTIDE, ARGININE
Authors:Reichen, C., Forzani, C., Zhou, T., Parmeggiani, F., Fleishman, S.J., Mittl, P.R.E., Madhurantakam, C., Honegger, A., Ewald, C., Zerbe, O., Baker, D., Caflisch, A., Pluckthun, A.
Deposit date:2014-10-27
Release date:2016-01-13
Last modified:2016-11-09
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Computationally Designed Armadillo Repeat Proteins for Modular Peptide Recognition.
J.Mol.Biol., 428, 2016
4D4E
  • Download 4d4e
  • View 4d4e
Molmil generated image of 4d4e
CRYSTAL STRUCTURE OF COMPUTATIONALLY DESIGNED ARMADILLO REPEAT PROTEINS FOR MODULAR PEPTIDE RECOGNITION.
Descriptor:ARMADILLO REPEAT PROTEIN ARM00016, GLYCEROL
Authors:Reichen, C., Forzani, C., Zhou, T., Parmeggiani, F., Fleishman, S.J., Mittl, P.R.E., Madhurantakam, C., Honegger, A., Ewald, C., Zerbe, O., Baker, D., Caflisch, A., Pluckthun, A.
Deposit date:2014-10-28
Release date:2016-01-13
Last modified:2016-11-09
Method:X-RAY DIFFRACTION (2 Å)
Cite:Computationally Designed Armadillo Repeat Proteins for Modular Peptide Recognition.
J.Mol.Biol., 428, 2016
4DCL
  • Download 4dcl
  • View 4dcl
Molmil generated image of 4dcl
COMPUTATIONALLY DESIGNED SELF-ASSEMBLING TETRAHEDRON PROTEIN, T308, CRYSTALLIZED IN SPACE GROUP F23
Descriptor:Putative acetyltransferase SACOL2570
Authors:Sawaya, M.R., King, N.P., Sheffler, W., Baker, D., Yeates, T.O.
Deposit date:2012-01-17
Release date:2012-06-06
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (3.35 Å)
Cite:Computational design of self-assembling protein nanomaterials with atomic level accuracy.
Science, 336, 2012
4DDF
  • Download 4ddf
  • View 4ddf
Molmil generated image of 4ddf
COMPUTATIONALLY DESIGNED SELF-ASSEMBLING OCTAHEDRAL CAGE PROTEIN, O333, CRYSTALLIZED IN SPACE GROUP P4
Descriptor:Propanediol utilization polyhedral body protein PduT, SULFATE ION, CHLORIDE ION
Authors:Sawaya, M.R., King, N.P., Sheffler, W., Baker, D., Yeates, T.O.
Deposit date:2012-01-18
Release date:2012-06-06
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (3.15 Å)
Cite:Computational design of self-assembling protein nanomaterials with atomic level accuracy.
Science, 336, 2012
4DQ1
  • Download 4dq1
  • View 4dq1
Molmil generated image of 4dq1
THYMIDYLATE SYNTHASE FROM STAPHYLOCOCCUS AUREUS.
Descriptor:Thymidylate synthase, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE
Authors:Osipiuk, J., Holowicki, J., Jedrzejczak, R., Rubin, E., Guinn, K., Ioerger, T., Baker, D., Sacchettini, J., Joachimiak, A., Midwest Center for Structural Genomics (MCSG), Structures of Mtb Proteins Conferring Susceptibility to Known Mtb Inhibitors (MTBI)
Deposit date:2012-02-14
Release date:2012-03-21
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Thymidylate synthase from Staphylococcus aureus.
To be Published
4DRT
  • Download 4drt
  • View 4drt
Molmil generated image of 4drt
THREE DIMENSIONAL STRUCTURE OF DE NOVO DESIGNED SERINE HYDROLASE OSH26, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR89
Descriptor:de novo designed serine hydrolase, OR89, SODIUM ION, ...
Authors:Kuzin, A., Su, M., Rajagopalan, S., Seetharaman, J., Sahdev, S., Xiao, R., Ciccosanti, C., Baker, D., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-02-17
Release date:2012-04-18
Last modified:2014-10-08
Method:X-RAY DIFFRACTION (2.002 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4EGG
  • Download 4egg
  • View 4egg
Molmil generated image of 4egg
COMPUTATIONALLY DESIGNED SELF-ASSEMBLING TETRAHEDRON PROTEIN, T310
Descriptor:Putative acetyltransferase SACOL2570, GLYCEROL
Authors:Sawaya, M.R., King, N.P., Sheffler, W., Baker, D., Yeates, T.O.
Deposit date:2012-03-30
Release date:2012-05-30
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:Computational design of self-assembling protein nanomaterials with atomic level accuracy.
Science, 336, 2012
4ESS
  • Download 4ess
  • View 4ess
Molmil generated image of 4ess
CRYSTAL STRUCTURE OF E6D/L155R VARIANT OF DE NOVO DESIGNED SERINE HYDROLASE OSH55, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR187
Descriptor:OR187
Authors:Kuzin, A., Su, M., Seetharaman, J., Kornhaber, K., Kornhaber, G., Rajagopalan, S., Baker, D., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-04-23
Release date:2012-06-13
Last modified:2014-05-14
Method:X-RAY DIFFRACTION (1.9971 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4ETJ
  • Download 4etj
  • View 4etj
Molmil generated image of 4etj
CRYSTAL STRUCTURE OF E6H VARIANT OF DE NOVO DESIGNED SERINE HYDROLASE OSH55, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR185
Descriptor:Serine hydrolase, CHLORIDE ION, 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, ...
Authors:Kuzin, A., Su, M., Seetharaman, J., Kornhaber, K., Kornhaber, G., Rajagopalan, S., Baker, D., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-04-24
Release date:2012-06-13
Last modified:2014-05-14
Method:X-RAY DIFFRACTION (2.203 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4ETK
  • Download 4etk
  • View 4etk
Molmil generated image of 4etk
CRYSTAL STRUCTURE OF E6A/L130D/A155H VARIANT OF DE NOVO DESIGNED SERINE HYDROLASE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR186
Descriptor:De novo designed serine hydrolase, SODIUM ION
Authors:Kuzin, A., Su, M., Seetharaman, J., Kornhaber, K., Kornhaber, G., Rajagopalan, S., Baker, D., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-04-24
Release date:2012-06-13
Last modified:2014-05-14
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4FB7
  • Download 4fb7
  • View 4fb7
Molmil generated image of 4fb7
THE APO FORM OF IDOLE-3-GLYCEROL PHOSPHATE SYNTHASE (TRPC) FORM MYCOBACTERIUM TUBERCULOSIS
Descriptor:Indole-3-glycerol phosphate synthase, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
Authors:Michalska, K., Chhor, G., Jedrzejczak, R., Terwilliger, T.C., Rubin, E.J., Guinn, K., Baker, D., Ioerger, T.R., Sacchettini, J.C., Joachimiak, A., Structures of Mtb Proteins Conferring Susceptibility to Known Mtb Inhibitors (MTBI), Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-05-22
Release date:2012-06-13
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:The apo form of idole-3-glycerol phosphate synthase (TrpC) form Mycobacterium tuberculosis
To be Published
4FFD
  • Download 4ffd
  • View 4ffd
Molmil generated image of 4ffd
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR48
Descriptor:PF00702 DOMAIN PROTEIN, MAGNESIUM ION
Authors:Seetharaman, J., Lew, S., Nivon, L., Baker, D., Bjelic, S., Ciccosanti, C., Sahdev, S., Xiao, R., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-05-31
Release date:2013-02-13
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Crystal structure of engineered protein. northeast structural genomics consortium target or48
To be Published
4HB7
  • Download 4hb7
  • View 4hb7
Molmil generated image of 4hb7
THE STRUCTURE OF DIHYDROPTEROATE SYNTHASE FROM STAPHYLOCOCCUS AUREUS SUBSP. AUREUS MU50.
Descriptor:Dihydropteroate synthase, 1,2-ETHANEDIOL
Authors:Cuff, M.E., Holowicki, J., Jedrzejczak, R., Terwilliger, T.C., Rubin, E.J., Guinn, K., Baker, D., Ioerger, T.R., Sacchettini, J.C., Joachimiak, A., Midwest Center for Structural Genomics (MCSG), Structures of Mtb Proteins Conferring Susceptibility to Known Mtb Inhibitors (MTBI)
Deposit date:2012-09-27
Release date:2012-10-17
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The Structure of Dihydropteroate Synthase from Staphylococcus aureus subsp. aureus Mu50.
TO BE PUBLISHED
4ILS
  • Download 4ils
  • View 4ils
Molmil generated image of 4ils
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR117
Descriptor:Engineered protein
Authors:Seetharaman, J., Lew, S., Nivon, L., Baker, D., Bjelic, S., Ciccosanti, C., Sahdev, S., Xiao, R., Everett, J.K., Acton, T.B., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2012-12-31
Release date:2013-03-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of engineered protein. northeast structural genomics Consortium target or117
To be Published
4IWW
  • Download 4iww
  • View 4iww
Molmil generated image of 4iww
COMPUTATIONAL DESIGN OF AN UNNATURAL AMINO ACID METALLOPROTEIN WITH ATOMIC LEVEL ACCURACY
Descriptor:Unnatural Amino Acid Mediated Metalloprotein, SULFATE ION, COBALT (II) ION
Authors:Mills, J., Bolduc, J., Khare, S., Stoddard, B., Baker, D.
Deposit date:2013-01-24
Release date:2013-08-21
Last modified:2013-09-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Computational design of an unnatural amino Acid dependent metalloprotein with atomic level accuracy.
J.Am.Chem.Soc., 135, 2013
4IX0
  • Download 4ix0
  • View 4ix0
Molmil generated image of 4ix0
COMPUTATIONAL DESIGN OF AN UNNATURAL AMINO ACID METALLOPROTEIN WITH ATOMIC LEVEL ACCURACY
Descriptor:Unnatural Amino Acid Mediated Metalloprotein, NICKEL (II) ION, SULFATE ION
Authors:Mills, J., Bolduc, J., Khare, S., Stoddard, B., Baker, D.
Deposit date:2013-01-24
Release date:2013-08-21
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Computational design of an unnatural amino Acid dependent metalloprotein with atomic level accuracy.
J.Am.Chem.Soc., 135, 2013
4J29
  • Download 4j29
  • View 4j29
Molmil generated image of 4j29
CRYSTAL STRUCTURE OF ENGINEERED PROTEIN. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET OR258.
Descriptor:Engineered Protein OR258
Authors:Vorobiev, S., Su, M., Koga, R., Seetharaman, J., Koga, N., Mao, L., Xiao, R., Kohan, E., Castelllanos, J., Everett, J.K., Acton, T.B., Baker, D., Montelione, G.T., Tong, L., Hunt, J.F., Northeast Structural Genomics Consortium (NESG)
Deposit date:2013-02-04
Release date:2013-03-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Structure of Engineered Protein OR258.
To be Published