KinCore

PDB: 3ZDU — CMGC CDKL3_HUMAN

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	1	100.0%	3ZDUA

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name
CMGC	CDKL3	CDKL3_HUMAN	3ZDUA	Q8IVW4	1	309	592.0	38R:350	Type1	Inactive	DFGin	6.9833	13.0392	BLAminus	-143.7, 178.45	75.18, 92.44	-117.63, 14.0	312.63, 106.11	-57.98, -32.14	in-in	in	7.9857	Saltbr-in	2.6985	HRD-in	-64.55, -51.2	80.41, 3.99	in-in-out	SNCiio	in-out	ActLoopNT-in	2.9866	ActLoopCT-out	nonTYR	APEdihe_aaoii	APEdist_iioo	APE10-dihe-na	-62.89, -51.38	APE9-dihe-na	-62.26, -29.28	APE8-dihe-out	-61.11, -38.54	APE8-rot-in	294.07	APE67-dihe-in	-64.92, -21.83	-53.29, -37.08	APE12-dist-in	11.8498	APE11-dist-in	11.0369	APE10-dist-out	16.5273	APE9-dist-out	10.7679	T158D,Y160E	None	None	XRAY	2.2	0.217	0.262	A	325.0	297.0	12	28	23	5	[[4, 286]]	1.0	3zdu	CMGC_CDKL3_HUMAN	CMGC	9.3e-79	270.8	1.0	301.0	301.0	142	143	144	146	148	33	50	54	122	124	123	125.0	183	170	165	164	163	162	161	160	159	80	Cyclin-dependent kinase-like 3

PDB: 3ZDU — CMGC CDKL3_HUMAN

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	1	100.0%	3ZDUA

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Species	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name
CMGC	CDKL3	CDKL3_HUMAN	3ZDUA	Q8IVW4	1	309	592.0	38R:350	Type1	Inactive	DFGin	6.9833	13.0392	BLAminus	-143.7, 178.45	75.18, 92.44	-117.63, 14.0	312.63, 106.11	-57.98, -32.14	in-in	in	7.9857	Saltbr-in	2.6985	HRD-in	-64.55, -51.2	80.41, 3.99	in-in-out	SNCiio	in-out	ActLoopNT-in	2.9866	ActLoopCT-out	nonTYR	APEdihe_aaoii	APEdist_iioo	APE10-dihe-na	-62.89, -51.38	APE9-dihe-na	-62.26, -29.28	APE8-dihe-out	-61.11, -38.54	APE8-rot-in	294.07	APE67-dihe-in	-64.92, -21.83	-53.29, -37.08	APE12-dist-in	11.8498	APE11-dist-in	11.0369	APE10-dist-out	16.5273	APE9-dist-out	10.7679	T158D,Y160E	None	None	XRAY	2.2	0.217	0.262	A	325.0	297.0	12	28	23	5	[[4, 286]]	1.0	3zdu	Homo sapiens	CMGC_CDKL3_HUMAN	CMGC	9.3e-79	270.8	1.0	301.0	301.0	142	143	144	146	148	33	50	54	122	124	123	125.0	183	170	165	164	163	162	161	160	159	80	Cyclin-dependent kinase-like 3

PDB: 3ZDU — CMGC CDKL3_HUMAN

Total number of chains: 0

Active chains: 0

Total number of genes: 0

Spatial label	Dihedral label	Number of Chains	Percent	Representative

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Species	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name