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234,136 Structures from the PDB

1,068,577 Computed Structure Models (CSM)

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QUERY: Citation Author = "Gray, N.S."

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Search Summary

This query matches 149 Structures.

Refinements

Structure Determination Methodology

experimental (149)

Scientific Name of Source Organism

	Homo sapiens (144)
	Mus musculus (3)
	synthetic construct (3)
	Gallus gallus (2)
	Nakaseomyces glabratus (1)
	Xenopus laevis (1)

Taxonomy

	Eukaryota (149)
	other sequences (3)

Experimental Method

	X-RAY DIFFRACTION (146)
	ELECTRON MICROSCOPY (2)
	SOLUTION NMR (1)

Polymer Entity Type

	Protein (149)
	DNA (2)

Refinement Resolution (Å)

	1.0 - 1.5 (11)
	1.5 - 2.0 (29)
	2.0 - 2.5 (59)
	2.5 - 3.0 (35)
	3.0 - 3.5 (9)
	3.5 - 4.0 (3)
	4.0 - 4.5 (1)
	> 4.5 (1)

Release Date

	1995 - 1999 (5)
	2000 - 2004 (1)
	2005 - 2009 (7)
	2010 - 2014 (23)
	2015 - 2019 (68)
	2020 - 2024 (45)

Enzyme Classification Name

	Transferases (116)
	Hydrolases (11)
	Isomerases (1)

Symmetry Type

	Asymmetric (124)
	Cyclic (28)
	Dihedral (3)

SCOP Classification

	Alpha and beta proteins (a+b) (77)
	Artifacts (37)
	All beta proteins (5)
	Alpha and beta proteins (a/b) (7)
	All alpha proteins (9)

AllSelected

1 to 25 of 149 Structures

Page 1 of 6

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1AJ7 \| pdb_00001aj7	Download File View File

IMMUNOGLOBULIN 48G7 GERMLINE FAB ANTIBODY COMPLEXED WITH HAPTEN 5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID. AFFINITY MATURATION OF AN ESTEROLYTIC ANTIBODY

Wedemayer, G.J., Wang, L.H., Patten, P.A., Schultz, P.G., Stevens, R.C.

(1997) Science 276: 1665-1669

Released	1997-11-12
Method	X-RAY DIFFRACTION 2.1 Å
Organisms	Homo sapiens Mus musculus
Macromolecule	IMMUNOGLOBULIN 48G7 FAB (HEAVY CHAIN) (protein) IMMUNOGLOBULIN 48G7 FAB (LIGHT CHAIN) (protein)
Unique Ligands	NPE

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1CKP \| pdb_00001ckp	Download File View File

HUMAN CYCLIN DEPENDENT KINASE 2 COMPLEXED WITH THE INHIBITOR PURVALANOL B

Gray, N.S., Thunnissen, A.M.W.H., Schultz, P.G., Kim, S.H.

(1998) Science 281: 533-538

Released	1999-01-13
Method	X-RAY DIFFRACTION 2.05 Å
Organisms	Homo sapiens
Macromolecule	PROTEIN (CYCLIN-DEPENDENT PROTEIN KINASE 2) (protein)
Unique Ligands	EDO, PVB

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1DM2 \| pdb_00001dm2	Download File View File

HUMAN CYCLIN-DEPENDENT KINASE 2 COMPLEXED WITH THE INHIBITOR HYMENIALDISINE

Thunnissen, A.M., Kim, S.-H.

(2000) Chem Biol 7: 51-63

Released	2000-05-31
Method	X-RAY DIFFRACTION 2.1 Å
Organisms	Homo sapiens
Macromolecule	CYCLIN-DEPENDENT KINASE 2 (protein)
Unique Ligands	EDO, HMD

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1GAF \| pdb_00001gaf	Download File View File

48G7 HYBRIDOMA LINE FAB COMPLEXED WITH HAPTEN 5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID

Wedemayer, G.J., Patten, P.A., Stevens, R.C., Schultz, P.G.

(1996) Science 271: 1086-1091

Released	1996-07-11
Method	X-RAY DIFFRACTION 1.95 Å
Organisms	Homo sapiens
Macromolecule	CHIMERIC 48G7 FAB (protein)
Unique Ligands	NPE

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1HKL \| pdb_00001hkl	Download File View File

FREE AND LIGANDED FORM OF AN ESTEROLYTIC CATALYTIC ANTIBODY

Wedemayer, G.J., Wang, L.H., Patten, P.A., Schultz, P.G., Stevens, R.C.

(1997) J Mol Biology 268: 390-400

Released	1997-03-12
Method	X-RAY DIFFRACTION 2.68 Å
Organisms	Homo sapiens
Macromolecule	48G7 FAB (protein)

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2HIW \| pdb_00002hiw	Download File View File

Crystal Structure of Inactive Conformation Abl Kinase Catalytic Domain Complexed with Type II Inhibitor

Lee, C.

(2006) Chem Biol 13: 779-786

Released	2006-08-22
Method	X-RAY DIFFRACTION 2.2 Å
Organisms	Homo sapiens
Macromolecule	Proto-oncogene tyrosine-protein kinase ABL1 (protein)
Unique Ligands	7MP

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2RCS \| pdb_00002rcs	Download File View File

IMMUNOGLOBULIN 48G7 GERMLINE FAB-AFFINITY MATURATION OF AN ESTEROLYTIC ANTIBODY

Wedemayer, G.J., Wang, L.H., Patten, P.A., Schultz, P.G., Stevens, R.C.

(1997) Science 276: 1665-1669

Released	1997-11-12
Method	X-RAY DIFFRACTION 2.1 Å
Organisms	Homo sapiens Mus musculus
Macromolecule	IMMUNOGLOBULIN 48G7 GERMLINE FAB (protein)

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2VGP \| pdb_00002vgp	Download File View File

Crystal structure of Aurora B kinase in complex with a aminothiazole inhibitor

Andersen, C.B., Wan, Y., Chang, J.W., Lee, C., Liu, Y., Sessa, F., Villa, F., Nallan, L., Musacchio, A., Gray, N.S.

(2008) ACS Chem Biol 3: 180

Released	2008-02-26
Method	X-RAY DIFFRACTION 1.7 Å
Organisms	Xenopus laevis
Macromolecule	INNER CENTROMERE PROTEIN A (protein) SERINE/THREONINE-PROTEIN KINASE 12-A (protein)
Unique Ligands	AD6

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3CEK \| pdb_00003cek	Download File View File

Crystal structure of human dual specificity protein kinase (TTK)

Filippakopoulos, P., Soundararajan, M., Keates, T., Elkins, J.M., King, O., Fedorov, O., Picaud, S.S., Pike, A.C.W., Roos, A., Pilka, E., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Weigelt, J., Bountra, C., Knapp, S., Structural Genomics Consortium (SGC)

(2010) Nat Chem Biol 6: 359-368

Released	2008-03-18
Method	X-RAY DIFFRACTION 2.3 Å
Organisms	Homo sapiens
Macromolecule	Dual specificity protein kinase TTK (protein)
Unique Ligands	7PE

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3DQW \| pdb_00003dqw	Download File View File

c-Src kinase domain Thr338Ile mutant in complex with ATPgS

Azam, M., Seeliger, M.A., Gray, N., Kuriyan, J., Daley, G.Q.

(2008) Nat Struct Mol Biol 15: 1109-1118

Released	2008-09-23
Method	X-RAY DIFFRACTION 2.017 Å
Organisms	Gallus gallus
Macromolecule	Proto-oncogene tyrosine-protein kinase Src (protein)
Unique Ligands	AGS, MG

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3DQX \| pdb_00003dqx	Download File View File

chicken c-Src kinase domain in complex with ATPgS

Azam, M., Seeliger, M.A., Gray, N., Kuriyan, J., Daley, G.Q.

(2008) Nat Struct Mol Biol 15: 1109-1118

Released	2008-09-23
Method	X-RAY DIFFRACTION 2.3 Å
Organisms	Gallus gallus
Macromolecule	Proto-oncogene tyrosine-protein kinase Src (protein)
Unique Ligands	AMP

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3GFW \| pdb_00003gfw	Download File View File

Crystal Structure of Human Dual Specificity Protein Kinase (TTK) in complex with a pyrolo-pyridin ligand

Filippakopoulos, P., Soundararajan, M., Choi, H., Keates, T., Elkins, J.M., King, O., Fedorov, O., Picaud, S.S., Pike, A.C.W., von Delft, F., Arrowsmith, C.H., Edwards, A., Weigelt, J., Bountra, C., Grey, N., Knapp, S., Structural Genomics Consortium (SGC)

(2010) Nat Chem Biol 6: 359-368

Released	2009-03-17
Method	X-RAY DIFFRACTION 2.74 Å
Organisms	Homo sapiens
Macromolecule	Dual specificity protein kinase TTK (protein)
Unique Ligands	7PE, S22

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3H9F \| pdb_00003h9f	Download File View File

Crystal Structure of Human Dual Specificity Protein Kinase (TTK) in complex with a pyrimido-diazepin ligand

Filippakopoulos, P., Soundararajan, M., Keates, T., Elkins, J.M., King, O., Fedorov, O., Picaud, S.S., Pike, A.C.W., Yue, W., Chaikuad, A., von Delft, F., Arrowsmith, C.H., Edwards, A., Weigelt, J., Bountra, C., Kwiatkowski, N., Gray, N.S., Knapp, S., Structural Genomics Consortium (SGC)

(2010) Nat Chem Biol 6: 359-368

Released	2009-05-19
Method	X-RAY DIFFRACTION 2.6 Å
Organisms	Homo sapiens
Macromolecule	Dual specificity protein kinase TTK (protein)
Unique Ligands	92M, MG

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3IKA \| pdb_00003ika	Download File View File

Crystal Structure of EGFR 696-1022 T790M Mutant Covalently Binding to WZ4002

Yun, C.-H., Eck, M.J.

(2009) Nature 462: 1070-1074

Released	2010-01-12
Method	X-RAY DIFFRACTION 2.9 Å
Organisms	Homo sapiens
Macromolecule	Epidermal growth factor receptor (protein)
Unique Ligands	0UN

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3K5V \| pdb_00003k5v	Download File View File

Structure of Abl kinase in complex with imatinib and GNF-2

Cowan-Jacob, S.W., Fendrich, G., Rummel, G., Strauss, A.

(2010) Nature 463: 501-506

Released	2010-01-19
Method	X-RAY DIFFRACTION 1.74 Å
Organisms	Mus musculus
Macromolecule	Tyrosine-protein kinase ABL1 (protein)
Unique Ligands	CL, STI, STJ

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3V6R \| pdb_00003v6r	Download File View File

Discovery of potent and selective covalent inhibitors of JNK

Park, H., LoGrasso, P.V., Laughlin, J.D.

(2012) Chem Biol 19: 140-154

Released	2012-02-01
Method	X-RAY DIFFRACTION 2.6 Å
Organisms	Homo sapiens
Macromolecule	Mitogen-activated protein kinase 10 (protein)
Unique Ligands	CQQ

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3V6S \| pdb_00003v6s	Download File View File

Discovery of potent and selective covalent inhibitors of JNK

Park, H., Laughlin, J.D., LoGrasso, P.V.

(2012) Chem Biol 19: 140-154

Released	2012-02-01
Method	X-RAY DIFFRACTION 2.97 Å
Organisms	Homo sapiens
Macromolecule	Mitogen-activated protein kinase 10 (protein)
Unique Ligands	0F0

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4B99 \| pdb_00004b99	Download File View File

Crystal Structure of MAPK7 (ERK5) with inhibitor

Elkins, J.M., Wang, J., Vollmar, M., Mahajan, P., Savitsky, P., Deng, X., Gray, N.S., Pike, A.C.W., von Delft, F., Bountra, C., Arrowsmith, C., Edwards, A., Knapp, S.

(2013) J Med Chem 56: 4413

Released	2012-09-19
Method	X-RAY DIFFRACTION 2.8 Å
Organisms	Homo sapiens
Macromolecule	MITOGEN-ACTIVATED PROTEIN KINASE 7 (protein)
Unique Ligands	R4L

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4CKR \| pdb_00004ckr	Download File View File

Crystal structure of the human DDR1 kinase domain in complex with DDR1-IN-1

Canning, P., Elkins, J.M., Goubin, S., Mahajan, P., Krojer, T., Newman, J.A., Dixon-Clarke, S., Chaikuad, A., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Bountra, C., Bullock, A.

(2013) ACS Chem Biol 8: 2145

Released	2014-01-15
Method	X-RAY DIFFRACTION 2.2 Å
Organisms	Homo sapiens
Macromolecule	EPITHELIAL DISCOIDIN DOMAIN-CONTAINING RECEPTOR 1 (protein)
Unique Ligands	DI1, EDO

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4D7X \| pdb_00004d7x	Download File View File

Solution Structure of the Mediator Gall11 KIX Domain of C. Glabrata

Boeszoermenyi, A., Wagner, G., Naar, A.M., Arthanari, H.

(2016) Nature 530: 485

Released	2015-12-09
Method	SOLUTION NMR
Organisms	Nakaseomyces glabratus
Macromolecule	MEDIATOR OF RNA POLYMERASE II TRANSCRIPTION SUBUNIT 15 (protein)

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4E93 \| pdb_00004e93	Download File View File

Crystal structure of human Feline Sarcoma Viral Oncogene Homologue (v-FES)in complex with TAE684

Filippakopoulos, P., Salah, E., Miduturu, C.V., Fedorov, O., Cooper, C., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Weigelt, J., Gray, N.S., Knapp, S., Structural Genomics Consortium (SGC)

(2012) Chem Biol 19: 529-540

Released	2012-04-18
Method	X-RAY DIFFRACTION 1.84 Å
Organisms	Homo sapiens
Macromolecule	Tyrosine-protein kinase Fes/Fps (protein)
Unique Ligands	GUI

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4LDJ \| pdb_00004ldj	Download File View File

Crystal Structure of a GDP-bound G12C Oncogenic Mutant of Human GTPase KRas

Hunter, J.C., Gurbani, D., Chen, Z., Westover, K.D.

(2014) Proc Natl Acad Sci U S A 111: 8895-8900

Released	2014-06-04
Method	X-RAY DIFFRACTION 1.15 Å
Organisms	Homo sapiens
Macromolecule	GTPase KRas (protein)
Unique Ligands	GDP, MG

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4NMM \| pdb_00004nmm	Download File View File

Crystal Structure of a G12C Oncogenic Variant of Human KRas Bound to a Novel GDP Competitive Covalent Inhibitor

Hunter, J.C., Gurbani, D., Lim, S.M., Westover, K.D.

(2014) Proc Natl Acad Sci U S A 111: 8895-8900

Released	2014-06-04
Method	X-RAY DIFFRACTION 1.89 Å
Organisms	Homo sapiens
Macromolecule	GTPase KRas (protein)
Unique Ligands	MG, Y9Z

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4O91 \| pdb_00004o91	Download File View File

Crystal Structure of type II inhibitor NG25 bound to TAK1-TAB1

Gurbani, D., Hunter, J.C., Tan, L., Westover, K.D.

(2015) J Med Chem 58: 183-196

Released	2014-07-30
Method	X-RAY DIFFRACTION 2.393 Å
Organisms	Homo sapiens
Macromolecule	Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1 chimera (protein)
Unique Ligands	NG2