Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

7G4J

Crystal Structure of rat Autotaxin in complex with 4-[rac-(E)-3-oxo-3-[rac-(3aR,8aS)-2-(1H-benzotriazole-5-carbonyl)-1,3,3a,4,5,7,8,8a-octahydropyrrolo[3,4-d]azepin-6-yl]prop-1-enyl]benzonitrile, i.e. SMILES C1C[C@@H]2[C@H](CCN1C(=O)/C=C/c1ccc(cc1)C#N)CN(C2)C(=O)c1ccc2c(c1)N=NN2 with IC50=0.193037 microM

Resources

File format		File name (file size)
PDBx/mmCIF		7g4j.cif.gz Display(189.37 KB) 7g4j.cif
PDBx/mmJSON	all	7g4j.json.gz Display (Tree)(125.07 KB) 7g4j.json
	no-atom	7g4j-noatom.json.gz Display (Header)(24.81 KB) 7g4j-noatom.json
	add only	7g4j-plus.json.gz Display(1.85 KB) 7g4j-plus.json
PDBML	all	7g4j.xml.gz Display(252.90 KB) 7g4j.xml
	no-atom	7g4j-noatom.xml.gz Display(48.80 KB) 7g4j-noatom.xml
	ext-atom	7g4j-extatom.xml.gz Display(153.52 KB) 7g4j-extatom.xml
pdb_nextgen	all	pdb_00007g4j_xyz-enrich.cif.gz Display(207.66 KB) pdb_00007g4j_xyz-enrich.cif
	no-atom	pdb_00007g4j_xyz-no-atom-enrich.xml.gz Display(59.07 KB) pdb_00007g4j_xyz-no-atom-enrich.xml
	ng-only	7g4j-plus.json.gz Display(4.71 KB) 7g4j-plus.json
PDB		pdb7g4j.ent.gz Display(143.86 KB) pdb7g4j.ent
RDF		7g4j.rdf.gz Visualize(140.75 KB) 7g4j.rdf
Structure factors		r7g4jsf.ent.gz Display(5.03 MB) r7g4jsf.ent
Biological unit (mmCIF format)		7g4j-assembly1.cif.gz Display(176.04 KB) 7g4j-assembly1.cif (A) *author and software defined assembly, 1 molecule(s) (monomeric)
Biological unit (PDB format)		7g4j.pdb1.gz Display(137.53 KB) 7g4j.pdb1 (A) *author and software defined assembly, 1 molecule(s) (monomeric)
Validation reports	PDF	7g4j_validation.pdf.gz Display(1.01 MB) 7g4j_validation.pdf
	PDF-full	7g4j_full_validation.pdf.gz Display(1.02 MB) 7g4j_full_validation.pdf
	mmCIF	7g4j_validation.cif.gz Display(49.93 KB) 7g4j_validation.cif
	XML	7g4j_validation.xml.gz Display(36.74 KB) 7g4j_validation.xml
	PNG	7g4j_multipercentile_validation.png.gz Display(171.24 KB) 7g4j_multipercentile_validation.png
	SVG	7g4j_multipercentile_validation.svg.gz Display(977.00 B) 7g4j_multipercentile_validation.svg
EDMap	2fo-fc (PDBx/mmCIF)	7g4j_validation_2fo-fc_map_coef.cif.gz Display(552.82 KB) 7g4j_validation_2fo-fc_map_coef.cif
	fo-fc (PDBx/mmCIF)	7g4j_validation_fo-fc_map_coef.cif.gz Display(554.04 KB) 7g4j_validation_fo-fc_map_coef.cif
	2fo-fc (MTZ)	7g4j_validation_2fo-fc_map_coef.mtz Visualize(910.72 KB)
	fo-fc (MTZ)	7g4j_validation_fo-fc_map_coef.mtz Visualize(910.72 KB)

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)