Ligand: 3RJ

Total number of chains: 5
Active chains: 4
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 80.0% 4WNPA
DFGin ABAminus 1 20.0% 6U5LA
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
OTHER ULK1 ULK1_HUMAN 4WNPA O75385 7 280 1050.0 3RJ:303 Type1 Active DFGin 6.9947 15.046 BLAminus -119.62, 166.82 69.01, 82.0 -103.27, 16.67 279.97, 77.71 -62.76, -23.51 in-in in 7.9397 Saltbr-in 2.4986 HRD-in -81.76, -53.0 76.62, 2.2 in-in-in SNCiii in-in ActLoopNT-in 2.9163 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.2, 168.11 APE9-dihe-na 114.36, -176.46 APE8-dihe-in -108.19, 123.53 APE8-rot-in 302.32 APE67-dihe-in -68.78, -16.2 -37.83, -49.18 APE12-dist-in 8.382 APE11-dist-in 11.2854 APE10-dist-in 5.8447 APE9-dist-in 3.2832 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 A 287.0 274.0 0 27 27 0 [[14, 278]] 1.0 4wnp OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPB O75385 8 280 1050.0 3RJ:401 Type1 Active DFGin 6.9145 14.9328 BLAminus -122.94, 171.73 60.52, 83.99 -103.78, 20.71 282.68, 81.42 -62.77, -26.15 in-in in 7.9339 Saltbr-in 2.715 HRD-in -83.74, -50.92 75.53, -1.19 in-in-in SNCiii in-in ActLoopNT-in 2.9053 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.85, 169.04 APE9-dihe-na 112.7, -177.08 APE8-dihe-in -104.59, 125.84 APE8-rot-in 311.45 APE67-dihe-in -71.84, -13.3 -49.94, -37.17 APE12-dist-in 8.2329 APE11-dist-in 11.3348 APE10-dist-in 5.8273 APE9-dist-in 3.3339 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 B 287.0 273.0 0 27 27 0 [[14, 278]] 1.0 4wnp OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPC O75385 8 279 1050.0 3RJ:401 Type1 Active DFGin 6.841 14.8427 BLAminus -127.5, 176.17 60.94, 81.17 -99.91, 16.61 282.52, 78.24 -54.0, -30.6 in-in in 7.7873 Saltbr-in 2.4112 HRD-in -84.07, -52.11 74.67, -1.37 in-in-in SNCiii in-in ActLoopNT-in 2.8816 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -151.28, 173.48 APE9-dihe-na 103.65, -175.78 APE8-dihe-in -104.7, 127.64 APE8-rot-in 300.66 APE67-dihe-in -75.42, -10.53 -35.46, -48.63 APE12-dist-in 8.1797 APE11-dist-in 10.9896 APE10-dist-in 5.5595 APE9-dist-in 3.3506 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 C 287.0 272.0 0 27 27 0 [[14, 278]] 1.0 4wnp OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPD O75385 8 280 1050.0 3RJ:401 Type1 Active DFGin 6.7973 14.8786 BLAminus -124.34, 171.93 65.59, 80.61 -102.54, 20.8 278.75, 73.99 -65.45, -24.99 in-in in 7.7709 Saltbr-in 2.487 HRD-in -82.27, -50.67 73.86, 1.16 in-in-in SNCiii in-in ActLoopNT-in 2.9338 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -154.24, 170.11 APE9-dihe-na 114.27, -170.33 APE8-dihe-in -112.74, 130.56 APE8-rot-in 315.18 APE67-dihe-in -73.84, -10.36 -37.5, -50.28 APE12-dist-in 8.2805 APE11-dist-in 11.2593 APE10-dist-in 5.832 APE9-dist-in 3.3089 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 D 287.0 273.0 0 27 27 0 [[14, 278]] 1.0 4wnp OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK4 ULK4_HUMAN 6U5LA Q96C45 1 285 1275.0 3RJ:60301 Type1 Pseudo DFGin 6.226 18.4547 ABAminus -136.12, 15.31 -157.37, 109.67 -112.82, 20.67 287.68, 79.1 -55.24, -38.19 out-na out 13.9621 Saltbr-na 999.0 HRD-in -80.42, -35.75 72.37, -25.3 na-in-out SNCaio in-out ActLoopNT-in 2.7147 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iooi APE10-dihe-na -90.65, 119.09 APE9-dihe-na -89.22, -142.79 APE8-dihe-in -86.05, 132.82 APE8-rot-out 161.95 APE67-dihe-in -66.84, -35.55 -76.04, -11.61 APE12-dist-in 8.9476 APE11-dist-out 6.3279 APE10-dist-out 9.1575 APE9-dist-in 5.9932 K172A,K173A None None XRAY 1.75 0.192 0.216 A 287.0 274.0 11 51 40 11 [[4, 280]] 1.0 6u5l OTHER_ULK4_HUMAN ULK 9.2e-119 401.4 1.0 256.0 256.0 138 139 140 142 144 34 46 50 118 120 119 121.0 201 189 184 183 182 181 180 179 178 76 Serine/threonine-protein kinase ULK4

Ligand: 3RJ

Total number of chains: 5
Active chains: 4
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 80.0% 4WNPA
DFGin ABAminus 1 20.0% 6U5LA
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
OTHER ULK1 ULK1_HUMAN 4WNPA O75385 7 280 1050.0 3RJ:303 Type1 Active DFGin 6.9947 15.046 BLAminus -119.62, 166.82 69.01, 82.0 -103.27, 16.67 279.97, 77.71 -62.76, -23.51 in-in in 7.9397 Saltbr-in 2.4986 HRD-in -81.76, -53.0 76.62, 2.2 in-in-in SNCiii in-in ActLoopNT-in 2.9163 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.2, 168.11 APE9-dihe-na 114.36, -176.46 APE8-dihe-in -108.19, 123.53 APE8-rot-in 302.32 APE67-dihe-in -68.78, -16.2 -37.83, -49.18 APE12-dist-in 8.382 APE11-dist-in 11.2854 APE10-dist-in 5.8447 APE9-dist-in 3.2832 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 A 287.0 274.0 0 27 27 0 [[14, 278]] 1.0 4wnp Homo sapiens OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPB O75385 8 280 1050.0 3RJ:401 Type1 Active DFGin 6.9145 14.9328 BLAminus -122.94, 171.73 60.52, 83.99 -103.78, 20.71 282.68, 81.42 -62.77, -26.15 in-in in 7.9339 Saltbr-in 2.715 HRD-in -83.74, -50.92 75.53, -1.19 in-in-in SNCiii in-in ActLoopNT-in 2.9053 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -149.85, 169.04 APE9-dihe-na 112.7, -177.08 APE8-dihe-in -104.59, 125.84 APE8-rot-in 311.45 APE67-dihe-in -71.84, -13.3 -49.94, -37.17 APE12-dist-in 8.2329 APE11-dist-in 11.3348 APE10-dist-in 5.8273 APE9-dist-in 3.3339 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 B 287.0 273.0 0 27 27 0 [[14, 278]] 1.0 4wnp Homo sapiens OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPC O75385 8 279 1050.0 3RJ:401 Type1 Active DFGin 6.841 14.8427 BLAminus -127.5, 176.17 60.94, 81.17 -99.91, 16.61 282.52, 78.24 -54.0, -30.6 in-in in 7.7873 Saltbr-in 2.4112 HRD-in -84.07, -52.11 74.67, -1.37 in-in-in SNCiii in-in ActLoopNT-in 2.8816 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -151.28, 173.48 APE9-dihe-na 103.65, -175.78 APE8-dihe-in -104.7, 127.64 APE8-rot-in 300.66 APE67-dihe-in -75.42, -10.53 -35.46, -48.63 APE12-dist-in 8.1797 APE11-dist-in 10.9896 APE10-dist-in 5.5595 APE9-dist-in 3.3506 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 C 287.0 272.0 0 27 27 0 [[14, 278]] 1.0 4wnp Homo sapiens OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK1 ULK1_HUMAN 4WNPD O75385 8 280 1050.0 3RJ:401 Type1 Active DFGin 6.7973 14.8786 BLAminus -124.34, 171.93 65.59, 80.61 -102.54, 20.8 278.75, 73.99 -65.45, -24.99 in-in in 7.7709 Saltbr-in 2.487 HRD-in -82.27, -50.67 73.86, 1.16 in-in-in SNCiii in-in ActLoopNT-in 2.9338 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -154.24, 170.11 APE9-dihe-na 114.27, -170.33 APE8-dihe-in -112.74, 130.56 APE8-rot-in 315.18 APE67-dihe-in -73.84, -10.36 -37.5, -50.28 APE12-dist-in 8.2805 APE11-dist-in 11.2593 APE10-dist-in 5.832 APE9-dist-in 3.3089 E37A,K38A TPO180 TPO180 XRAY 1.88 0.194 0.226 D 287.0 273.0 0 27 27 0 [[14, 278]] 1.0 4wnp Homo sapiens OTHER_ULK1_HUMAN ULK 2.1e-132 446.2 1.0 256.0 256.0 164 165 166 168 170 46 63 67 135 137 136 138.0 203 191 186 185 184 183 182 181 180 93 Serine/threonine-protein kinase ULK1
OTHER ULK4 ULK4_HUMAN 6U5LA Q96C45 1 285 1275.0 3RJ:60301 Type1 Pseudo DFGin 6.226 18.4547 ABAminus -136.12, 15.31 -157.37, 109.67 -112.82, 20.67 287.68, 79.1 -55.24, -38.19 out-na out 13.9621 Saltbr-na 999.0 HRD-in -80.42, -35.75 72.37, -25.3 na-in-out SNCaio in-out ActLoopNT-in 2.7147 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iooi APE10-dihe-na -90.65, 119.09 APE9-dihe-na -89.22, -142.79 APE8-dihe-in -86.05, 132.82 APE8-rot-out 161.95 APE67-dihe-in -66.84, -35.55 -76.04, -11.61 APE12-dist-in 8.9476 APE11-dist-out 6.3279 APE10-dist-out 9.1575 APE9-dist-in 5.9932 K172A,K173A None None XRAY 1.75 0.192 0.216 A 287.0 274.0 11 51 40 11 [[4, 280]] 1.0 6u5l Homo sapiens OTHER_ULK4_HUMAN ULK 9.2e-119 401.4 1.0 256.0 256.0 138 139 140 142 144 34 46 50 118 120 119 121.0 201 189 184 183 182 181 180 179 178 76 Serine/threonine-protein kinase ULK4

Ligand: 3RJ

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