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4WA7
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CRYSTAL STRUCTURE OF A GDP-BOUND Q61L ONCOGENIC MUTANT OF HUMAN GT- PASE KRAS
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Hunter, J.C., Manandhar, A., Gurbani, D., Chen, Z., Westover, K.D.
Deposit date:2014-08-28
Release date:2015-06-10
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.986 Å)
Cite:Biochemical and Structural Analysis of Common Cancer-Associated KRAS Mutations.
Mol Cancer Res., 13, 2015
5KYK
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COVALENT GTP-COMPETITIVE INHIBITORS OF KRAS G12C: GUANOSINE BISPHOSPHONATE ANALOGS
Descriptor:GTPase KRas, 5'-O-[(R)-[({2-[(chloroacetyl)amino]ethyl}sulfamoyl)methyl](hydroxy)phosphoryl]guanosine
Authors:Xiong, Y., Lu, J., Hunter, J., Li, L., Scott, D., Manandhar, A., Gondi, S., Westover, K.D., Gray, N.S.
Deposit date:2016-07-21
Release date:2017-04-12
Method:X-RAY DIFFRACTION (2.702 Å)
Cite:Covalent Guanosine Mimetic Inhibitors of G12C KRAS.
ACS Med Chem Lett, 8, 2017
5MLA
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CRYSTAL STRUCTURE OF HUMAN RAS IN COMPLEX WITH DARPIN K55
Descriptor:GTPase KRas, darpin k55, MAGNESIUM ION, ...
Authors:Debreczeni, J.E., Guillard, S., Kolasinska-Zwierz, P., Breed, J., Zhang, J., Bery, N., Marwood, R., Tart, J., Overman, R., Stocki, P., Mistry, B., Phillips, C., Rabbitts, T., Jackson, R., Minter, R.
Deposit date:2016-12-06
Release date:2017-12-20
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Inhibition of RAS nucleotide exchange by a DARPin: structural characterisation and effects on downstream signalling by active RAS
To Be Published
5MLB
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CRYSTAL STRUCTURE OF HUMAN RAS IN COMPLEX WITH DARPIN K27
Descriptor:GTPase KRas, DARPin K27, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Debreczeni, J.E., Guillard, S., Kolasinska-Zwierz, P., Breed, J., Zhang, J., Bery, N., Marwood, R., Tart, J., Overman, R., Stocki, P., Mistry, B., Phillips, C., Rabbitts, T., Jackson, R., Minter, R.
Deposit date:2016-12-06
Release date:2017-12-20
Method:X-RAY DIFFRACTION (3.22 Å)
Cite:INhibition of RAS nucleotide exchange by a DARPin: structural characterisation and effects on downstream signalling by active RAS
To Be Published
5O2S
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HUMAN KRAS IN COMPLEX WITH DARPIN K27
Descriptor:GTPase KRas, darpin K27, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Debreczeni, J.E., Guillard, S., Kolasinska-Zwierz, P., Breed, J., Zhang, J., Bery, N., Marwood, R., Tart, J., Stocki, P., Mistry, B., Phillips, C., Rabbitts, T., Jackson, R., Minter, R.
Deposit date:2017-05-22
Release date:2017-07-26
Method:X-RAY DIFFRACTION (3.22 Å)
Cite:Structural and functional characterization of a DARPin which inhibits Ras nucleotide exchange.
Nat Commun, 8, 2017
5O2T
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HUMAN KRAS IN COMPLEX WITH DARPIN K27
Descriptor:GTPase KRas, darpin 55, MAGNESIUM ION, ...
Authors:Debreczeni, J.E., Guillard, S., Kolasinska-Zwierz, P., Breed, J., Zhang, J., Bery, N., Marwood, R., Tart, J., Stocki, P., Mistry, B., Phillips, C., Rabbitts, T., Jackson, R., Minter, R.
Deposit date:2017-05-22
Release date:2017-07-26
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Structural and functional characterization of a DARPin which inhibits Ras nucleotide exchange.
Nat Commun, 8, 2017
5OCG
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DISCOVERY OF SMALL MOLECULES BINDING TO KRAS VIA HIGH AFFINITY ANTIBODY FRAGMENT COMPETITION METHOD.
Descriptor:GTPase KRas, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ...
Authors:Cruz-Migoni, A., Ehebauer, M.T., Phillips, S.E.V., Quevedo, C.E., Rabbitts, T.H.
Deposit date:2017-06-30
Release date:2018-08-22
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Small molecule inhibitors of RAS-effector protein interactions derived using an intracellular antibody fragment.
Nat Commun, 9, 2018
5OCO
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DISCOVERY OF SMALL MOLECULES BINDING TO KRAS VIA HIGH AFFINITY ANTIBODY FRAGMENT COMPETITION METHOD.
Descriptor:GTPase KRas, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ~{N}-[[(3~{R})-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]furan-2-carboxamide, ...
Authors:Cruz-Migoni, A., Ehebauer, M.T., Phillips, S.E.V., Quevedo, C.E., Rabbitts, T.H.
Deposit date:2017-07-03
Release date:2018-08-22
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Small molecule inhibitors of RAS-effector protein interactions derived using an intracellular antibody fragment.
Nat Commun, 9, 2018
5OCT
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DISCOVERY OF SMALL MOLECULES BINDING TO KRAS VIA HIGH AFFINITY ANTIBODY FRAGMENT COMPETITION METHOD.
Descriptor:GTPase KRas, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, [(2~{R})-6-chloranyl-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine, ...
Authors:Cruz-Migoni, A., Ehebauer, M.T., Phillips, S.E.V., Quevedo, C.E., Rabbitts, T.H.
Deposit date:2017-07-03
Release date:2018-08-22
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Small molecule inhibitors of RAS-effector protein interactions derived using an intracellular antibody fragment.
Nat Commun, 9, 2018
5TAR
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CRYSTAL STRUCTURE OF FARNESYLATED AND METHYLATED KRAS4B IN COMPLEX WITH PDE-DELTA (CRYSTAL FORM II - WITH ORDERED HYPERVARIABLE REGION)
Descriptor:GTPase KRas, Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta, FARNESYL, ...
Authors:Dharmaiah, S., Tran, T.H., Simanshu, D.K.
Deposit date:2016-09-10
Release date:2016-11-02
Last modified:2016-11-16
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural basis of recognition of farnesylated and methylated KRAS4b by PDE delta.
Proc.Natl.Acad.Sci.USA, 113, 2016
5TB5
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CRYSTAL STRUCTURE OF FULL-LENGTH FARNESYLATED AND METHYLATED KRAS4B IN COMPLEX WITH PDE-DELTA (CRYSTAL FORM I - WITH PARTIALLY DISORDERED HYPERVARIABLE REGION)
Descriptor:GTPase KRas, Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta, FARNESYL, ...
Authors:Dharmaiah, S., Tran, T.H., Simanshu, D.K.
Deposit date:2016-09-11
Release date:2016-11-02
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural basis of recognition of farnesylated and methylated KRAS4b by PDE delta.
Proc.Natl.Acad.Sci.USA, 113, 2016
5UFE
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WILD-TYPE K-RAS(GNP)/R11.1.6 COMPLEX
Descriptor:GTPase KRas, R11.1.6, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ...
Authors:Parker, J.A., Mattos, C.
Deposit date:2017-01-04
Release date:2017-08-02
Method:X-RAY DIFFRACTION (2.302 Å)
Cite:An engineered protein antagonist of K-Ras/B-Raf interaction.
Sci Rep, 7, 2017
5UFQ
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K-RASG12D(GNP)/R11.1.6 COMPLEX
Descriptor:GTPase KRas, R11.1.6, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ...
Authors:Parker, J.A., Mattos, C.
Deposit date:2017-01-05
Release date:2017-08-02
Method:X-RAY DIFFRACTION (2.199 Å)
Cite:An engineered protein antagonist of K-Ras/B-Raf interaction.
Sci Rep, 7, 2017
5UK9
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WILD-TYPE K-RAS(GCP) PH 6.5
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Parker, J.A., Mattos, C.
Deposit date:2017-01-20
Release date:2018-01-10
Last modified:2018-06-20
Method:X-RAY DIFFRACTION (1.887 Å)
Cite:K-Ras Populates Conformational States Differently from Its Isoform H-Ras and Oncogenic Mutant K-RasG12D.
Structure, 26, 2018
5UQW
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CRYSTAL STRUCTURE OF HUMAN KRAS G12V MUTANT IN COMPLEX WITH GDP
Descriptor:GTPase KRas, MAGNESIUM ION, GUANOSINE-5'-DIPHOSPHATE
Authors:Huang, C.S., Kaplan, A., Stockwell, B.R., Tong, L.
Deposit date:2017-02-08
Release date:2017-03-22
Last modified:2017-09-27
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Multivalent Small-Molecule Pan-RAS Inhibitors.
Cell, 168, 2017
5US4
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CRYSTAL STRUCTURE OF HUMAN KRAS G12D MUTANT IN COMPLEX WITH GDP
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Tran, T., Kaplan, A., Stockwell, B.R., Tong, L.
Deposit date:2017-02-13
Release date:2017-03-22
Last modified:2018-03-07
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Multivalent Small-Molecule Pan-RAS Inhibitors.
Cell, 168, 2017
5USJ
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CRYSTAL STRUCTURE OF HUMAN KRAS G12D MUTANT IN COMPLEX WITH GDPNP
Descriptor:GTPase KRas, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER
Authors:Huang, C.S., Kaplan, A., Stockwell, B.R., Tong, L.
Deposit date:2017-02-13
Release date:2017-03-22
Last modified:2017-09-27
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Multivalent Small-Molecule Pan-RAS Inhibitors.
Cell, 168, 2017
5V6S
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CRYSTAL STRUCTURE OF SMALL MOLECULE ACRYLAMIDE 1 COVALENTLY BOUND TO K-RAS G12C
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:McGregor, L.M., Jenkins, M., Kerwin, C., Burke, J.E., Shokat, K.M.
Deposit date:2017-03-17
Release date:2017-06-28
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Expanding the Scope of Electrophiles Capable of Targeting K-Ras Oncogenes.
Biochemistry, 56, 2017
5V6V
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CRYSTAL STRUCTURE OF SMALL MOLECULE AZIRIDINE 3 COVALENTLY BOUND TO K-RAS G12C
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, CALCIUM ION, ...
Authors:McGregor, L.M., Jenkins, M., Kerwin, C., Burke, J.E., Shokat, K.M.
Deposit date:2017-03-17
Release date:2017-06-28
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Expanding the Scope of Electrophiles Capable of Targeting K-Ras Oncogenes.
Biochemistry, 56, 2017
5V71
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KRAS G12C IN BOUND TO QUINAZOLINE BASED SWITCH II POCKET (SWIIP) BINDER
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Westover, K., Lu, J.
Deposit date:2017-03-17
Release date:2017-08-23
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.228 Å)
Cite:KRAS G12C Drug Development: Discrimination between Switch II Pocket Configurations Using Hydrogen/Deuterium-Exchange Mass Spectrometry.
Structure, 25, 2017
5V9L
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KRAS G12C IN BOUND TO QUINAZOLINE BASED SWITCH II POCKET (SWIIP) BINDER
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Westover, K., Lu, J.
Deposit date:2017-03-23
Release date:2017-08-23
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.981 Å)
Cite:Potent and Selective Covalent Quinazoline Inhibitors of KRAS G12C.
Cell Chem Biol, 24, 2017
5V9O
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KRAS G12C INHIBITOR
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Westover, K., Lu, J.
Deposit date:2017-03-23
Release date:2017-08-23
Last modified:2017-08-30
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Potent and Selective Covalent Quinazoline Inhibitors of KRAS G12C.
Cell Chem Biol, 24, 2017
5V9U
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CRYSTAL STRUCTURE OF SMALL MOLECULE ARS-1620 COVALENTLY BOUND TO K-RAS G12C
Descriptor:GTPase KRas, CALCIUM ION, (S)-1-{4-[6-chloro-8-fluoro-7-(2-fluoro-6-hydroxyphenyl)quinazolin-4-yl] piperazin-1-yl}propan-1-one, ...
Authors:Janes, M.R., Zhang, J., Li, L.-S., Hansen, R., Peters, U., Guo, X., Chen, Y., Babbar, A., Firdaus, S.J., Feng, J., Chen, J.H., Li, S., Brehmer, D., Darjania, L., Li, S., Long, Y.O., Thach, C., Liu, Y., Zarieh, A., Ely, T., Kucharski, J.M., Kessler, L.V., Wu, T., Wang, Y., Yao, Y., Deng, X., Zarrinkar, P., Dashyant, D., Lorenzi, M.V., Hu-Lowe, D., Patricelli, M.P., Ren, P., Liu, Y.
Deposit date:2017-03-23
Release date:2018-02-07
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Targeting KRAS Mutant Cancers with a Covalent G12C-Specific Inhibitor.
Cell, 172, 2018
5VBM
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CRYSTAL STRUCTURE OF SMALL MOLECULE DISULFIDE 2C07 BOUND TO K-RAS CYS LIGHT M72C GDP
Descriptor:GTPase KRas, MAGNESIUM ION, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Gentile, D.R., Jenkins, M.L., Moss, S.M., Burke, J.E., Shokat, K.M.
Deposit date:2017-03-29
Release date:2017-10-25
Last modified:2018-01-03
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:Ras Binder Induces a Modified Switch-II Pocket in GTP and GDP States.
Cell Chem Biol, 24, 2017
5VP7
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CRYSTAL STRUCTURE OF HUMAN KRAS G12A MUTANT IN COMPLEX WITH GDP
Descriptor:GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Xu, S., Long, B., Boris, G., Chen, A., Ni, S., Kennedy, M.A.
Deposit date:2017-05-04
Release date:2017-12-06
Last modified:2017-12-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural insight into the rearrangement of the switch I region in GTP-bound G12A K-Ras.
Acta Crystallogr D Struct Biol, 73, 2017
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