4RFM

3D Structure View

CAVITIES

STRUCTURE SETTINGS

LIGANDS

Chain 4RFM_A

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GENERAL

TITLE

ITK KINASE DOMAIN IN COMPLEX WITH COMPOUND 1 N-{1-[(1,1-DIOXO-1-THIAN- 2-YL)(PHENYL)METHYL]-1H- PYRAZOL-4-YL}-5,5-DIFLUORO-5A-METHYL-1H,4H, 4AH,5H,5AH,6H-CYCLOPROPA[F]INDAZOLE-3-CARBOXAMIDE

DATE LAST MODIFIED

26 Aug 2015

RELEASE

29 Apr 2015

OBSOLETE

CLASSIFICATION

TRANSFERASE/INHIBITOR

EXPERIMENT TYPE

X-RAY DIFFRACTION

SPACE GROUP

P 1 21 1

RESOLUTION RANGE HIGH

2.1

RESOLUTION RANGE LOW

32.47

PUBMED ID

25844760

DOI

10.1021/JM501998M

PDBe

LIGANDS

745701

Chains

Structure Chain	Target Protein	Gene	Expression System	Organism	Synonims	Actions
	P25043	ITK, EMT, LYK	SPODOPTERA FRUGIPERDA	HUMAN	INTERLEUKIN-2-INDUCIBLE T-CELL KINASE, IL-2-INDUCI ...

NGL Viewer is used for the molecular visualization.

AS Rose, AR Bradley, Y Valasatava, JM Duarte, A Prlić and PW Rose. NGL viewer: web-based molecular graphics for large complexes. Bioinformatics: bty419, 2018. doi:10.1093/bioinformatics/bty419
AS Rose and PW Hildebrand. NGL Viewer: a web application for molecular visualization. Nucl Acids Res (1 July 2015) 43 (W1): W576-W579 first published online April 29, 2015. doi:10.1093/nar/gkv402