Ligand: 3I7

Total number of chains: 4
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 4D2TD
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
CAMK MELK MELK_HUMAN 4D2TA Q14680 1 333 651.0 3I7:61334 Type1 Inactive DFGin 6.5851 15.5947 BLAminus -133.48, 179.68 57.39, 75.1 -93.78, 24.78 286.01, 83.45 -43.02, -42.14 in-in in 9.1836 Saltbr-in 2.7995 HRD-in -58.97, -47.79 71.72, 5.83 in-in-out SNCiio in-out ActLoopNT-in 3.4538 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nooi APE10-dihe-na -76.88, 125.32 APE9-dihe-na -93.77, -97.24 APE8-dihe-in -114.6, 140.81 APE8-rot-none 999.0 APE67-dihe-in -50.7, -28.44 -65.82, -47.52 APE12-dist-none 999.0 APE11-dist-out 4.7314 APE10-dist-out 9.3684 APE9-dist-in 3.793 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 A 356.0 316.0 17 29 17 12 [[11, 263]] 1.0 4d2t CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TB Q14680 1 333 651.0 3I7:61334 Type1 None DFGin 6.5171 15.4821 BLAminus -134.63, -178.27 55.46, 74.9 -94.29, 23.67 286.62, 83.25 -66.74, -35.72 in-in in 9.1486 Saltbr-in 2.7878 HRD-in -58.96, -48.62 71.55, 4.62 in-in-none SNCiin in-none ActLoopNT-in 2.8087 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnii APE10-dihe-na 999.0, -118.25 APE9-dihe-na 126.7, -132.88 APE8-dihe-in -115.61, 136.66 APE8-rot-none 999.0 APE67-dihe-in -51.25, -29.04 -60.65, -47.38 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-in 6.181 APE9-dist-in 3.7237 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 B 356.0 322.0 11 29 23 6 [[11, 263]] 1.0 4d2t CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TC Q14680 1 333 651.0 3I7:61334 Type1 None DFGin 6.6299 15.5937 BLAminus -134.25, 179.33 57.66, 74.82 -93.87, 24.92 285.83, 82.78 -70.22, -25.26 in-in in 9.1534 Saltbr-in 2.7964 HRD-in -57.46, -50.13 71.26, 4.63 in-in-none SNCiin in-none ActLoopNT-in 2.796 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -131.47 APE8-dihe-in -117.46, 135.5 APE8-rot-none 999.0 APE67-dihe-in -52.13, -27.45 -60.57, -47.15 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.6849 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 C 356.0 313.0 20 29 16 13 [[11, 263]] 1.0 4d2t CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TD Q14680 3 333 651.0 3I7:61334 Type1 None DFGin 6.4951 15.5371 BLAminus -130.9, 164.85 58.81, 83.3 -99.74, 25.07 285.57, 83.05 -62.72, -39.18 in-in in 9.2669 Saltbr-in 2.7983 HRD-in -58.57, -49.69 71.95, 4.52 in-in-none SNCiin in-none ActLoopNT-in 2.7966 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -132.43 APE8-dihe-in -116.12, 138.43 APE8-rot-none 999.0 APE67-dihe-in -52.16, -28.22 -60.64, -47.61 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.7327 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 D 356.0 319.0 8 29 21 8 [[11, 263]] 1.0 4d2t CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase

Ligand: 3I7

Total number of chains: 4
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 4D2TD
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
CAMK MELK MELK_HUMAN 4D2TA Q14680 1 333 651.0 3I7:61334 Type1 Inactive DFGin 6.5851 15.5947 BLAminus -133.48, 179.68 57.39, 75.1 -93.78, 24.78 286.01, 83.45 -43.02, -42.14 in-in in 9.1836 Saltbr-in 2.7995 HRD-in -58.97, -47.79 71.72, 5.83 in-in-out SNCiio in-out ActLoopNT-in 3.4538 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nooi APE10-dihe-na -76.88, 125.32 APE9-dihe-na -93.77, -97.24 APE8-dihe-in -114.6, 140.81 APE8-rot-none 999.0 APE67-dihe-in -50.7, -28.44 -65.82, -47.52 APE12-dist-none 999.0 APE11-dist-out 4.7314 APE10-dist-out 9.3684 APE9-dist-in 3.793 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 A 356.0 316.0 17 29 17 12 [[11, 263]] 1.0 4d2t Homo sapiens CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TB Q14680 1 333 651.0 3I7:61334 Type1 None DFGin 6.5171 15.4821 BLAminus -134.63, -178.27 55.46, 74.9 -94.29, 23.67 286.62, 83.25 -66.74, -35.72 in-in in 9.1486 Saltbr-in 2.7878 HRD-in -58.96, -48.62 71.55, 4.62 in-in-none SNCiin in-none ActLoopNT-in 2.8087 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnii APE10-dihe-na 999.0, -118.25 APE9-dihe-na 126.7, -132.88 APE8-dihe-in -115.61, 136.66 APE8-rot-none 999.0 APE67-dihe-in -51.25, -29.04 -60.65, -47.38 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-in 6.181 APE9-dist-in 3.7237 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 B 356.0 322.0 11 29 23 6 [[11, 263]] 1.0 4d2t Homo sapiens CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TC Q14680 1 333 651.0 3I7:61334 Type1 None DFGin 6.6299 15.5937 BLAminus -134.25, 179.33 57.66, 74.82 -93.87, 24.92 285.83, 82.78 -70.22, -25.26 in-in in 9.1534 Saltbr-in 2.7964 HRD-in -57.46, -50.13 71.26, 4.63 in-in-none SNCiin in-none ActLoopNT-in 2.796 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -131.47 APE8-dihe-in -117.46, 135.5 APE8-rot-none 999.0 APE67-dihe-in -52.13, -27.45 -60.57, -47.15 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.6849 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 C 356.0 313.0 20 29 16 13 [[11, 263]] 1.0 4d2t Homo sapiens CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase
CAMK MELK MELK_HUMAN 4D2TD Q14680 3 333 651.0 3I7:61334 Type1 None DFGin 6.4951 15.5371 BLAminus -130.9, 164.85 58.81, 83.3 -99.74, 25.07 285.57, 83.05 -62.72, -39.18 in-in in 9.2669 Saltbr-in 2.7983 HRD-in -58.57, -49.69 71.95, 4.52 in-in-none SNCiin in-none ActLoopNT-in 2.7966 ActLoopCT-none nonTYR APEdihe_aaini APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -132.43 APE8-dihe-in -116.12, 138.43 APE8-rot-none 999.0 APE67-dihe-in -52.16, -28.22 -60.64, -47.61 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.7327 T167A,S171A,N213T,V214A,M215A,Y218V,K219A None None XRAY 2.7 0.273 0.34 D 356.0 319.0 8 29 21 8 [[11, 263]] 1.0 4d2t Homo sapiens CAMK_MELK_HUMAN CAMK 4.6e-87 297.7 1.0 256.0 256.0 149 150 151 153 155 40 57 61 129 131 130 132.0 191 178 173 172 171 170 169 168 167 87 Maternal embryonic leucine zipper kinase

Ligand: 3I7

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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