TKL_LRRK2 (Leucine-rich repeat serine/threonine-protein kinase 2)

Total number of chains: 42
Active chains: 7
Uniprot: LRRK2_HUMAN
Kinase Domain Residues: 1875 - 2134
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 12 28.6% 7LI4A
DFGin BLAminus 10 23.8% AF-Q5S007-K1A
DFGout BBAminus 8 19.0% 8U8AB
DFGin BLBplus 4 9.5% 6VP6A
DFGout None 4 9.5% 8FO9E
DFGin None 2 4.8% 8TZHA
None None 2 4.8% 8VH4A

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Gene 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
LRRK2 8FO9A Q5S007 1329 2527 2527.0 ATP:2602 ATPlike Active DFGin 6.2733 13.4102 BLAminus -138.23, -175.7 59.6, 64.71 -84.85, 53.99 305.84, 101.34 -78.49, -28.55 in-in in 7.8797 Saltbr-in 2.7348 HRD-in -107.83, -47.31 66.25, 1.81 in-in-in SNCiii in-in ActLoopNT-in 3.031 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.21, 156.34 APE9-dihe-na 139.24, 152.96 APE8-dihe-in -67.96, 127.7 APE8-rot-in 305.42 APE67-dihe-inflip 98.56, -16.69 -58.5, 136.92 APE12-dist-in 9.1834 APE11-dist-in 11.4868 APE10-dist-in 6.0039 APE9-dist-in 3.8159 None None None EM 3.48 999.0 999.0 A 2527.0 1173.0 0 26 26 0 [[1875, 2134]] 1.0 8fo9 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO9C Q5S007 1329 2527 2527.0 ATP:2602 ATPlike Active DFGin 6.2753 13.4053 BLAminus -138.14, -175.77 59.5, 64.85 -84.95, 53.97 305.9, 101.31 -78.52, -28.52 in-in in 7.8828 Saltbr-in 2.7293 HRD-in -108.59, -47.2 66.33, 1.76 in-in-in SNCiii in-in ActLoopNT-in 3.008 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.94, 156.21 APE9-dihe-na 139.37, 152.96 APE8-dihe-in -67.92, 127.71 APE8-rot-in 305.58 APE67-dihe-inflip 98.46, -16.81 -58.61, 136.94 APE12-dist-in 9.1767 APE11-dist-in 11.5032 APE10-dist-in 6.012 APE9-dist-in 3.8041 None None None EM 3.48 999.0 999.0 C 2527.0 1173.0 0 26 26 0 [[1875, 2134]] 1.0 8fo9 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 AF-Q5S007-K1A Q5S007 1867 2142 2527.0 No_ligand No_ligand Active DFGin 6.2289 13.0184 BLAminus -123.42, -177.15 48.16, 92.04 -100.88, 18.77 306.82, 91.94 -55.24, -29.66 in-in in 8.5226 Saltbr-in 2.7409 HRD-in -79.01, -43.93 67.99, -8.85 in-in-in SNCiii in-in ActLoopNT-in 2.8557 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -69.22, 143.85 APE9-dihe-na 143.4, 155.54 APE8-dihe-in -77.65, 123.56 APE8-rot-in 291.78 APE67-dihe-inflip 80.21, 1.47 -53.68, 143.02 APE12-dist-in 9.0778 APE11-dist-in 11.7091 APE10-dist-in 5.6489 APE9-dist-in 3.3733 None None None AF2 -1.0 1.0 1.0 A 276.0 276.0 0 26 26 0 [[1875, 2134]] 1.0 AF-Q5S007-K1 TKL_LRRK2_HUMAN TKL 3.4e-59 206.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 AF-Q5S007-K3A Q5S007 1867 2142 2527.0 No_ligand No_ligand Active DFGin 6.328 13.3987 BLAminus -133.98, -172.94 51.72, 69.61 -85.29, 16.73 308.68, 103.46 -56.98, -31.93 in-in in 8.3926 Saltbr-in 2.7668 HRD-in -86.23, -45.15 69.51, -3.36 in-in-in SNCiii in-in ActLoopNT-in 2.8818 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -81.61, 122.15 APE9-dihe-na 162.76, 154.5 APE8-dihe-in -73.2, 129.38 APE8-rot-in 298.65 APE67-dihe-inflip 69.21, 15.98 -53.32, 138.33 APE12-dist-in 9.2299 APE11-dist-in 11.9129 APE10-dist-in 5.9109 APE9-dist-in 3.4313 None None None AF2 -1.0 1.0 1.0 A 276.0 276.0 0 26 26 0 [[1875, 2134]] 1.0 AF-Q5S007-K3 TKL_LRRK2_HUMAN TKL 3.4e-59 206.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TXZA Q5S007 1334 2522 2527.0 A1N:2601 Type1 Active DFGin 5.902 13.0948 BLAminus -119.85, -169.49 50.07, 80.97 -87.42, 36.51 309.72, 108.58 -60.32, -41.76 in-in in 8.2367 Saltbr-in 2.6912 HRD-in -80.74, -21.83 59.24, -43.27 in-in-in SNCiii in-in ActLoopNT-in 3.0983 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -129.73, 163.14 APE9-dihe-na 133.8, 147.92 APE8-dihe-in -71.53, 133.95 APE8-rot-in 307.22 APE67-dihe-inflip 87.19, -6.79 -58.87, 140.06 APE12-dist-in 9.3457 APE11-dist-in 10.9548 APE10-dist-in 5.5272 APE9-dist-in 4.2857 None None None EM 3.05 999.0 999.0 A 1194.0 858.0 2 26 26 0 [[1875, 2134]] 1.0 8txz TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U7HC Q5S007 1329 2527 2527.0 A0T:2602 Type1 Active DFGin 6.6983 13.8151 BLAminus -151.89, 162.68 84.4, 53.96 -82.18, 68.13 318.52, 92.12 -89.42, -24.81 in-in in 8.7166 Saltbr-in 2.9911 HRD-in -80.66, -50.67 74.5, -8.1 in-in-in SNCiii in-in ActLoopNT-in 3.1994 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -120.02, 135.14 APE9-dihe-na 174.93, 137.62 APE8-dihe-in -66.66, 127.94 APE8-rot-in 301.78 APE67-dihe-inflip 117.57, -20.5 -57.74, 115.44 APE12-dist-in 9.2479 APE11-dist-in 11.8898 APE10-dist-in 6.338 APE9-dist-in 4.3411 None None None EM 3.8 999.0 999.0 C 1201.0 1111.0 0 26 26 0 [[1875, 2134]] 1.0 8u7h TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZCA Q5S007 1333 2522 2527.0 A1N:2601 Type1 Active DFGin 6.0408 13.1072 BLAminus -134.37, -169.11 59.32, 67.24 -87.67, 29.16 308.05, 110.26 -61.86, -42.21 in-in in 8.1259 Saltbr-in 2.6349 HRD-in -84.6, -55.91 75.29, -7.67 in-in-in SNCiii in-in ActLoopNT-in 3.233 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.26, 150.23 APE9-dihe-na 145.44, 148.58 APE8-dihe-in -73.74, 131.69 APE8-rot-in 285.07 APE67-dihe-inflip 88.6, -3.69 -59.24, 141.32 APE12-dist-in 9.0561 APE11-dist-in 11.2243 APE10-dist-in 5.5315 APE9-dist-in 3.5704 G2019S None None EM 2.7 999.0 999.0 A 1195.0 872.0 9 26 26 0 [[1875, 2134]] 1.0 8tzc TKL_LRRK2_HUMAN TKL 1.3e-56 198.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8SMCC Q5S007 1329 2527 2527.0 TVT:2602 Type1 Inactive DFGin 6.2551 14.331 BLAminus -151.88, 173.9 60.74, 67.04 -79.23, 54.05 290.31, 81.86 -72.94, -29.2 in-out in 8.7531 Saltbr-out 4.1538 HRD-in -106.77, -45.45 59.98, 13.21 out-in-out SNCoio in-out ActLoopNT-in 3.2443 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -134.51, -171.55 APE9-dihe-na 124.76, -144.62 APE8-dihe-in -154.79, 139.07 APE8-rot-out 178.61 APE67-dihe-inflip 104.6, -41.0 -57.79, 132.46 APE12-dist-in 9.701 APE11-dist-in 11.7459 APE10-dist-in 6.3147 APE9-dist-in 3.8159 None None None EM 4.02 999.0 999.0 C 1201.0 1084.0 0 26 26 0 [[1875, 2134]] 1.0 8smc TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO7C Q5S007 1329 2527 2527.0 4K4:2602 Type1 Inactive DFGin 6.3123 13.4308 BLAminus -139.62, -172.17 59.51, 63.49 -84.43, 55.49 307.71, 102.06 -84.67, -29.66 in-out in 8.394 Saltbr-out 4.3555 HRD-in -101.09, -54.55 67.14, -1.83 out-in-in SNCoii in-in ActLoopNT-in 3.1219 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -71.0, 153.99 APE9-dihe-na 157.61, -174.98 APE8-dihe-in -111.39, 127.24 APE8-rot-in 309.15 APE67-dihe-inflip 92.52, -18.58 -59.81, 139.65 APE12-dist-in 9.0942 APE11-dist-in 11.5555 APE10-dist-in 5.6425 APE9-dist-in 3.801 None None None EM 3.52 999.0 999.0 C 1201.0 1141.0 0 26 26 0 [[1875, 2134]] 1.0 8fo7 TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZGA Q5S007 1333 2522 2527.0 A1N:2601 Type1 Inactive DFGin 6.3599 13.2865 BLAminus -134.51, -172.26 58.22, 65.93 -89.73, 27.97 304.01, 111.0 -72.25, -10.98 in-out in 8.0479 Saltbr-out 4.6418 HRD-in -83.84, -36.4 70.02, -7.06 out-in-in SNCoii in-in ActLoopNT-in 2.9835 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.38, 154.59 APE9-dihe-na 133.01, 150.21 APE8-dihe-in -76.98, 130.91 APE8-rot-in 304.9 APE67-dihe-inflip 102.2, -9.16 -57.75, 128.19 APE12-dist-in 9.9536 APE11-dist-in 11.0137 APE10-dist-in 5.2931 APE9-dist-in 3.5709 I2020T None None EM 2.7 999.0 999.0 A 1190.0 906.0 2 26 26 0 [[1875, 2134]] 1.0 8tzg TKL_LRRK2_HUMAN TKL 2.3e-57 200.9 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 6VP8A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1491 13.5381 BLBplus -81.68, 148.11 43.57, 50.62 -72.43, 158.92 54.89, 92.79 125.38, 999.0 in-out in 7.9447 Saltbr-out 5.2252 HRD-in -73.85, -48.07 61.91, 23.91 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.13, 77.73 999.0, -140.5 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1198.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp8 TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 6VNOA Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1612 13.542 BLBplus -82.18, 148.25 43.35, 49.88 -75.1, 158.85 56.03, 91.04 126.75, 999.0 in-out in 7.9447 Saltbr-out 5.2208 HRD-in -73.59, -47.59 62.0, 23.37 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vno TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 6VP6A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1612 13.542 BLBplus -81.71, 148.21 43.95, 50.5 -72.87, 159.16 54.85, 89.9 125.39, 999.0 in-out in 7.9447 Saltbr-out 5.2208 HRD-in -75.0, -48.38 61.49, 26.99 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.47 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp6 TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 6VP7A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1485 13.5379 BLBplus -81.78, 147.88 44.05, 50.71 -72.61, 159.21 55.02, 89.94 124.84, 999.0 in-out in 7.9447 Saltbr-out 5.2255 HRD-in -73.43, -46.88 69.56, 9.74 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp7 TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZHA Q5S007 627 2522 2527.0 A1N:2601 Type1 Inactive DFGin 5.1887 13.0236 None -82.7, -162.66 -41.82, 136.94 -146.23, 112.92 28.36, 40.7 -50.64, 999.0 in-out in 9.2107 Saltbr-out 4.5645 HRD-in -114.23, -59.07 54.02, 31.73 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiii APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -53.84 APE8-dihe-in -145.38, 140.36 APE8-rot-in 326.06 APE67-dihe-in -90.26, -10.83 -64.13, -43.14 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.2169 None None None EM 3.9 999.0 999.0 A 2527.0 1485.0 21 26 12 14 [[1875, 2134]] 1.0 8tzh TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 9CHOA Q5S007 543 2527 2527.0 A1N:2701 Type1 Inactive DFGin 6.0139 12.2545 None -87.37, -156.77 -42.12, 141.81 -109.94, -179.33 314.03, 99.42 -59.72, 999.0 in-out in 9.1584 Saltbr-out 5.5545 HRD-in -73.99, -50.39 47.44, 27.45 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiii APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -45.86 APE8-dihe-in -153.53, 148.49 APE8-rot-in 317.08 APE67-dihe-in -67.05, -9.98 -58.64, -41.45 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.7475 I2020T None None EM 7.8 999.0 999.0 A 1985.0 1792.0 21 26 12 14 [[1875, 2134]] 1.0 9cho TKL_LRRK2_HUMAN TKL 4.9e-57 199.8 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 7LHTA Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8435 8.2947 None -64.84, 122.35 -98.75, -0.04 -71.37, -28.28 172.84, 65.91 -59.04, -42.88 out-out out 11.1561 Saltbr-out 7.8414 HRD-in -69.75, -40.92 72.72, -9.61 out-out-out SNCooo out-out ActLoopNT-out 9.7836 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.21, -17.19 APE9-dihe-na 90.26, 154.46 APE8-dihe-in -57.7, 141.99 APE8-rot-in 318.57 APE67-dihe-in -63.97, -43.36 -55.36, -52.39 APE12-dist-in 9.6726 APE11-dist-in 10.1449 APE10-dist-out 14.0961 APE9-dist-in 4.0969 None None None EM 3.5 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7lht TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 7LHTB Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8435 8.2947 None -64.86, 122.35 -98.72, -0.04 -71.37, -28.3 172.84, 65.9 -59.09, -42.88 out-out out 11.1564 Saltbr-out 7.8415 HRD-in -69.81, -40.92 72.73, -9.55 out-out-out SNCooo out-out ActLoopNT-out 9.783 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.22, -17.15 APE9-dihe-na 90.23, 154.47 APE8-dihe-in -57.69, 142.03 APE8-rot-in 318.55 APE67-dihe-in -64.0, -43.36 -55.37, -52.4 APE12-dist-in 9.6725 APE11-dist-in 10.1447 APE10-dist-out 14.096 APE9-dist-in 4.0969 None None None EM 3.5 999.0 999.0 B 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7lht TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 7LHWA Q5S007 540 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.3492 8.2774 None -70.88, 117.76 -93.02, 2.5 -63.92, -24.19 170.47, 59.39 -60.34, -43.84 out-out out 10.98 Saltbr-out 7.2575 HRD-in -74.65, -33.87 72.74, -12.12 out-out-out SNCooo out-out ActLoopNT-out 9.6308 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -74.42, -8.25 APE9-dihe-na 81.17, 153.49 APE8-dihe-in -58.6, 142.93 APE8-rot-in 304.43 APE67-dihe-in -63.74, -43.48 -51.59, -53.96 APE12-dist-in 10.2362 APE11-dist-in 9.4572 APE10-dist-out 13.8716 APE9-dist-in 4.3352 None None None EM 3.7 999.0 999.0 A 2527.0 1813.0 3 26 23 3 [[1875, 2134]] 1.0 7lhw TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 7LI4A Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8442 8.2944 None -64.77, 122.33 -98.76, -0.03 -71.41, -28.21 172.83, 65.95 -59.02, -42.88 out-out out 11.1566 Saltbr-out 7.8416 HRD-in -69.78, -40.92 72.72, -9.67 out-out-out SNCooo out-out ActLoopNT-out 9.7838 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.19, -17.19 APE9-dihe-na 90.26, 154.48 APE8-dihe-in -57.73, 142.01 APE8-rot-in 318.58 APE67-dihe-in -63.98, -43.36 -55.36, -52.38 APE12-dist-in 9.6727 APE11-dist-in 10.1448 APE10-dist-out 14.0958 APE9-dist-in 4.0959 None None None EM 3.1 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7li4 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO2E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.5492 8.1829 None -77.97, 115.31 -99.8, 16.1 -71.24, -24.34 179.0, 61.54 -64.41, -41.78 out-out out 11.347 Saltbr-out 7.8505 HRD-in -73.2, -35.27 72.81, -10.29 out-out-out SNCooo out-out ActLoopNT-out 9.492 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.29, -18.03 APE9-dihe-na 75.0, 160.57 APE8-dihe-in -64.56, 133.01 APE8-rot-in 300.63 APE67-dihe-in -63.84, -35.14 -59.88, -35.03 APE12-dist-in 9.1186 APE11-dist-in 10.5881 APE10-dist-out 14.4472 APE9-dist-in 4.3818 None None None EM 4.13 999.0 999.0 E 2527.0 2275.0 4 26 23 3 [[1875, 2134]] 1.0 8fo2 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO8C Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.4041 8.3667 None -77.76, 115.2 -99.79, 16.57 -70.68, -24.12 178.89, 61.58 -64.22, -41.72 out-out out 11.3412 Saltbr-out 7.7439 HRD-in -73.07, -35.29 72.76, -10.32 out-out-out SNCooo out-out ActLoopNT-out 9.4707 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.5, -18.26 APE9-dihe-na 74.89, 160.43 APE8-dihe-in -64.77, 133.4 APE8-rot-in 300.66 APE67-dihe-in -63.6, -35.05 -59.67, -34.64 APE12-dist-in 9.0713 APE11-dist-in 10.5217 APE10-dist-out 14.4112 APE9-dist-in 4.4488 None None None EM 3.88 999.0 999.0 C 2527.0 2270.0 4 26 23 3 [[1875, 2134]] 1.0 8fo8 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO8E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.4146 8.3493 None -77.68, 115.13 -99.83, 16.55 -70.64, -24.07 178.91, 61.52 -64.18, -41.73 out-out out 11.3208 Saltbr-out 7.7298 HRD-in -73.0, -35.27 72.87, -10.42 out-out-out SNCooo out-out ActLoopNT-out 9.4702 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.4, -18.35 APE9-dihe-na 74.93, 160.44 APE8-dihe-in -64.61, 133.34 APE8-rot-in 300.72 APE67-dihe-in -63.56, -35.05 -59.56, -34.8 APE12-dist-in 9.056 APE11-dist-in 10.5258 APE10-dist-out 14.406 APE9-dist-in 4.4342 None None None EM 3.88 999.0 999.0 E 2527.0 2270.0 4 26 23 3 [[1875, 2134]] 1.0 8fo8 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO9F Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.3478 8.5752 None -68.36, 152.72 -137.53, 18.95 -81.54, -22.77 187.88, 51.61 -70.19, -36.74 out-out out 11.2379 Saltbr-out 8.3264 HRD-in -76.93, -42.26 72.06, -11.17 out-out-out SNCooo out-out ActLoopNT-out 9.1058 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -70.82, -18.07 APE9-dihe-na 87.94, 175.98 APE8-dihe-in -63.48, 135.16 APE8-rot-in 300.23 APE67-dihe-in -66.37, -45.6 -58.88, -37.04 APE12-dist-in 9.7177 APE11-dist-in 10.5775 APE10-dist-out 14.122 APE9-dist-in 4.4728 None None None EM 3.48 999.0 999.0 F 2527.0 2289.0 3 26 23 3 [[1875, 2134]] 1.0 8fo9 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8VH5A Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive DFGinter 9.7464 8.455 None -88.01, 106.84 -81.35, 17.64 -78.83, -10.5 197.42, 64.93 -68.71, -22.79 out-out out 11.3256 Saltbr-out 8.1229 HRD-in -105.05, -49.61 72.56, -5.72 out-out-out SNCooo out-out ActLoopNT-out 8.9614 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -67.06, -23.38 APE9-dihe-na 73.72, 168.0 APE8-dihe-in -68.8, 143.98 APE8-rot-out 58.99 APE67-dihe-in -65.74, -54.3 -73.05, -29.17 APE12-dist-in 9.6328 APE11-dist-in 8.4163 APE10-dist-out 13.3438 APE9-dist-in 3.8609 None None None EM 4.0 999.0 999.0 A 2527.0 2221.0 8 26 18 8 [[1875, 2134]] 1.0 8vh5 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8VH5C Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive DFGinter 9.746 8.4552 None -88.01, 106.86 -81.36, 17.7 -78.84, -10.6 197.4, 64.92 -68.66, -22.76 out-out out 11.3253 Saltbr-out 8.1217 HRD-in -104.99, -49.63 72.52, -5.67 out-out-out SNCooo out-out ActLoopNT-out 8.9613 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -66.98, -23.42 APE9-dihe-na 73.64, 168.02 APE8-dihe-in -68.73, 143.93 APE8-rot-out 59.0 APE67-dihe-in -65.76, -54.24 -73.07, -29.13 APE12-dist-in 9.6328 APE11-dist-in 8.4176 APE10-dist-out 13.3446 APE9-dist-in 3.8618 None None None EM 4.0 999.0 999.0 C 2527.0 2221.0 8 26 18 8 [[1875, 2134]] 1.0 8vh5 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 7LI3A Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.5831 8.4031 None -64.7, 121.5 -105.97, 8.82 -69.04, -26.41 175.66, 65.26 -63.25, -46.61 out-out out 11.4013 Saltbr-out 8.1206 HRD-in -76.04, -34.97 73.14, -12.04 out-out-out SNCooo out-out ActLoopNT-out 9.6644 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -85.32, -9.76 APE9-dihe-na 87.27, 160.92 APE8-dihe-in -56.79, 143.13 APE8-rot-in 300.33 APE67-dihe-in -63.35, -39.62 -56.92, -55.07 APE12-dist-in 10.3855 APE11-dist-in 10.3625 APE10-dist-out 14.0058 APE9-dist-in 3.6521 None None None EM 3.8 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7li3 TKL_LRRK2_HUMAN TKL 3.9e-56 197.0 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 9CI3A Q5S007 907 2527 2527.0 No_ligand No_ligand Inactive DFGinter 10.474 8.2787 None -66.48, 130.02 -90.44, 1.88 -71.41, -23.46 187.57, 71.09 -65.75, -44.61 out-out out 11.2241 Saltbr-out 6.8631 HRD-in -66.49, -44.27 66.72, -4.67 out-out-out SNCooo out-out ActLoopNT-out 9.4202 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -69.6, -18.48 APE9-dihe-na 81.06, 161.8 APE8-dihe-in -67.87, 131.88 APE8-rot-in 311.06 APE67-dihe-in -65.99, -44.62 -57.57, -36.48 APE12-dist-in 9.7404 APE11-dist-in 9.3201 APE10-dist-out 13.7805 APE9-dist-in 4.5479 None SEP910,SEP935 SEP910,SEP935 EM 3.96 999.0 999.0 A 2562.0 1521.0 3 26 23 3 [[1875, 2134]] 1.0 9ci3 TKL_LRRK2_HUMAN TKL 3.9e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZBA Q5S007 1334 2522 2527.0 T3X:2601 Type2 Inactive DFGout 14.0658 10.7664 BBAminus -132.66, 154.43 -138.45, 96.4 -87.4, 60.9 334.47, 86.31 57.59, 999.0 in-out in 9.0019 Saltbr-out 5.5404 HRD-out -73.84, 143.19 -69.19, -64.34 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -72.6, -22.58 999.0, -105.88 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 3.1 999.0 999.0 A 2527.0 920.0 40 26 10 16 [[1875, 2134]] 1.0 8tzb TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U7LA Q5S007 558 2526 2527.0 T3X:2602 Type2 Inactive DFGout 14.9805 11.008 BBAminus -140.78, 146.38 -122.43, 95.19 -64.85, -14.51 319.76, 127.29 74.72, 24.72 in-out in 9.1479 Saltbr-out 3.8691 HRD-out -74.43, 79.23 -48.3, -61.63 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.46 APE8-dihe-in -63.34, 144.64 APE8-rot-none 999.0 APE67-dihe-in -74.67, -26.35 -63.34, -33.42 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.8338 None None None EM 3.6 999.0 999.0 A 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u7l TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U7LB Q5S007 558 2526 2527.0 T3X:2602 Type2 Inactive DFGout 14.984 11.014 BBAminus -140.53, 146.5 -122.41, 95.28 -64.83, -14.47 319.94, 127.4 74.7, 24.71 in-out in 9.1791 Saltbr-out 3.946 HRD-out -74.52, 79.38 -48.22, -61.54 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.39 APE8-dihe-in -63.16, 144.49 APE8-rot-none 999.0 APE67-dihe-in -74.6, -26.44 -63.18, -33.64 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.8475 None None None EM 3.6 999.0 999.0 B 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u7l TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U8AB Q5S007 558 2526 2527.0 0LI:2601 Type2 Inactive DFGout 14.859 10.8454 BBAminus -150.37, 144.32 -124.19, 97.68 -69.79, -11.11 321.73, 111.63 66.57, 27.33 in-out in 8.8739 Saltbr-out 3.6727 HRD-out -76.07, 95.41 -48.17, -63.17 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.03 APE8-dihe-in -61.6, 136.03 APE8-rot-in 305.18 APE67-dihe-in -74.33, -25.33 -56.72, -44.14 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.2972 None None None EM 3.4 999.0 999.0 B 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u8a TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U8AC Q5S007 558 2526 2527.0 0LI:2601 Type2 Inactive DFGout 14.8696 10.8459 BBAminus -150.46, 144.31 -124.23, 97.69 -69.77, -11.06 321.78, 111.5 66.48, 27.35 in-out in 8.8719 Saltbr-out 3.6608 HRD-out -76.02, 95.48 -48.33, -63.13 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.01 APE8-dihe-in -61.57, 135.98 APE8-rot-in 305.14 APE67-dihe-in -74.37, -25.35 -56.73, -44.17 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.3006 None None None EM 3.4 999.0 999.0 C 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u8a TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U8BA Q5S007 558 2527 2527.0 919:2602 Type2 Inactive DFGout 14.9848 10.7673 BBAminus -149.25, 136.17 -99.76, 91.29 -52.15, -10.61 276.36, 113.64 76.74, 3.44 in-out in 9.1775 Saltbr-out 4.7045 HRD-out -74.73, -14.63 57.07, -112.57 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -110.86 APE8-dihe-in -64.22, 146.58 APE8-rot-out 61.38 APE67-dihe-in -67.91, -38.53 -58.15, -35.54 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 7.1562 None None None EM 3.7 999.0 999.0 A 2527.0 1712.0 29 26 13 13 [[1875, 2134]] 1.0 8u8b TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U8BB Q5S007 558 2527 2527.0 919:2602 Type2 Inactive DFGout 15.1337 10.7613 BBAminus -149.27, 136.01 -99.86, 91.22 -52.2, -10.44 276.32, 113.8 76.86, 3.6 in-out in 9.1521 Saltbr-out 4.659 HRD-out -74.69, -14.68 57.08, -112.62 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -110.92 APE8-dihe-in -64.16, 146.68 APE8-rot-out 61.4 APE67-dihe-in -67.92, -38.48 -58.09, -35.58 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 7.1489 None None None EM 3.7 999.0 999.0 B 2527.0 1712.0 29 26 13 13 [[1875, 2134]] 1.0 8u8b TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TYQA Q5S007 1335 2525 2527.0 T3X:2601 Type2 Inactive DFGout 14.3305 11.0592 BBAminus -137.54, 169.5 -145.41, 104.05 -82.78, -8.0 323.29, 109.83 55.65, 41.77 in-out in 9.3025 Saltbr-out 3.848 HRD-out 58.33, 70.16 -50.78, -51.1 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 93.28, -8.85 999.0, 38.74 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 G2019S None None EM 2.99 999.0 999.0 A 2527.0 957.0 45 26 11 15 [[1875, 2134]] 1.0 8tyq TKL_LRRK2_HUMAN TKL 3.9e-56 197.0 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8FO9E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGout 11.3745 7.913 None -68.54, 152.71 -137.53, 21.65 -90.85, -9.64 146.2, 91.59 -82.02, -36.47 out-out out 11.1602 Saltbr-out 8.209 HRD-in -76.97, -42.35 72.15, -11.11 out-out-out SNCooo out-out ActLoopNT-out 9.123 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -70.77, -18.05 APE9-dihe-na 87.91, 175.95 APE8-dihe-in -63.49, 135.16 APE8-rot-in 300.24 APE67-dihe-in -66.44, -45.65 -58.78, -37.14 APE12-dist-in 9.6513 APE11-dist-in 10.5523 APE10-dist-out 14.083 APE9-dist-in 4.472 None None None EM 3.48 999.0 999.0 E 2527.0 2287.0 3 26 23 3 [[1875, 2134]] 1.0 8fo9 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 9DMIA Q5S007 1334 2526 2527.0 A1A7Q:2601 Type2 Inactive DFGout 15.84 8.13 None -143.34, 124.58 -90.2, 120.11 -102.11, 113.17 183.37, 75.07 -64.73, -43.31 in-out in 9.1947 Saltbr-out 5.7228 HRD-out -85.28, 107.16 -59.63, -51.47 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoi APE10-dihe-na 999.0, -16.67 APE9-dihe-na 132.14, 155.57 APE8-dihe-in -70.08, 157.55 APE8-rot-out 60.86 APE67-dihe-in -127.81, 0.85 -71.06, 7.57 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 13.1144 APE9-dist-in 5.003 None None None EM 3.35 999.0 999.0 A 1195.0 933.0 37 26 14 12 [[1875, 2134]] 1.0 9dmi TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZEA Q5S007 1624 2522 2527.0 T3X:2601 Type2 Inactive DFGout 14.7864 11.433 None -133.1, 147.85 -126.11, 97.45 -74.36, -179.05 327.53, 107.99 -78.96, -62.34 in-in in 8.3878 Saltbr-in 3.1059 HRD-out -92.7, 99.94 -63.72, -48.22 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -86.92, 6.14 999.0, -117.5 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 2.9 999.0 999.0 A 2527.0 787.0 35 26 11 15 [[1875, 2134]] 1.0 8tze TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8TZFA Q5S007 587 2522 2527.0 T3X:2602 Type2 Inactive DFGout 14.7857 9.9994 None -152.73, 148.88 -147.21, 93.65 -77.45, 164.4 333.33, 110.23 -85.3, -156.36 in-in in 8.8618 Saltbr-in 2.8693 HRD-out -76.29, 155.16 -83.05, -63.93 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -77.21, -21.56 999.0, -134.97 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 I2020T None None EM 3.4 999.0 999.0 A 2527.0 1589.0 24 26 11 15 [[1875, 2134]] 1.0 8tzf TKL_LRRK2_HUMAN TKL 6.8e-57 199.5 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8VH4A Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive None 999.0 999.0 None -94.14, 87.28 -74.17, 5.0 -60.35, -20.37 999.0, 999.0 -59.12, -33.8 out-none out 12.056 Saltbr-none 999.0 HRD-in -102.88, -51.08 73.15, -5.33 none-out-out SNCnoo out-out ActLoopNT-out 8.7502 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -76.21, -33.07 APE9-dihe-na 74.7, 171.21 APE8-dihe-in -59.82, 149.42 APE8-rot-out 184.58 APE67-dihe-in -66.4, -59.35 -67.96, -43.48 APE12-dist-in 10.2221 APE11-dist-in 9.4484 APE10-dist-out 13.4907 APE9-dist-in 4.0567 None None None EM 4.1 999.0 999.0 A 2527.0 2235.0 8 26 18 8 [[1875, 2134]] 1.0 8vh4 TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 8U1BA Q5S007 1952 2521 2527.0 No_ligand No_ligand Inactive None 999.0 999.0 None 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 none-none none 999.0 Saltbr-none 999.0 HRD-in -114.83, -57.08 66.3, -2.18 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 999.0, 999.0 999.0, 999.0 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 3.7 999.0 999.0 A 1194.0 461.0 124 26 0 26 [[1875, 2134]] 1.0 8u1b TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2

TKL_LRRK2 (Leucine-rich repeat serine/threonine-protein kinase 2)

Total number of chains: 42
Active chains: 7
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 12 28.6% 7LI4A
DFGin BLAminus 10 23.8% AF-Q5S007-K1A
DFGout BBAminus 8 19.0% 8U8AB
DFGin BLBplus 4 9.5% 6VP6A
DFGout None 4 9.5% 8FO9E
DFGin None 2 4.8% 8TZHA
None None 2 4.8% 8VH4A

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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
LRRK2 LRRK2_HUMAN 8FO9A Q5S007 1329 2527 2527.0 ATP:2602 ATPlike Active DFGin 6.2733 13.4102 BLAminus -138.23, -175.7 59.6, 64.71 -84.85, 53.99 305.84, 101.34 -78.49, -28.55 in-in in 7.8797 Saltbr-in 2.7348 HRD-in -107.83, -47.31 66.25, 1.81 in-in-in SNCiii in-in ActLoopNT-in 3.031 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.21, 156.34 APE9-dihe-na 139.24, 152.96 APE8-dihe-in -67.96, 127.7 APE8-rot-in 305.42 APE67-dihe-inflip 98.56, -16.69 -58.5, 136.92 APE12-dist-in 9.1834 APE11-dist-in 11.4868 APE10-dist-in 6.0039 APE9-dist-in 3.8159 None None None EM 3.48 999.0 999.0 A 2527.0 1173.0 0 26 26 0 [[1875, 2134]] 1.0 8fo9 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO9C Q5S007 1329 2527 2527.0 ATP:2602 ATPlike Active DFGin 6.2753 13.4053 BLAminus -138.14, -175.77 59.5, 64.85 -84.95, 53.97 305.9, 101.31 -78.52, -28.52 in-in in 7.8828 Saltbr-in 2.7293 HRD-in -108.59, -47.2 66.33, 1.76 in-in-in SNCiii in-in ActLoopNT-in 3.008 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.94, 156.21 APE9-dihe-na 139.37, 152.96 APE8-dihe-in -67.92, 127.71 APE8-rot-in 305.58 APE67-dihe-inflip 98.46, -16.81 -58.61, 136.94 APE12-dist-in 9.1767 APE11-dist-in 11.5032 APE10-dist-in 6.012 APE9-dist-in 3.8041 None None None EM 3.48 999.0 999.0 C 2527.0 1173.0 0 26 26 0 [[1875, 2134]] 1.0 8fo9 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN AF-Q5S007-K1A Q5S007 1867 2142 2527.0 No_ligand No_ligand Active DFGin 6.2289 13.0184 BLAminus -123.42, -177.15 48.16, 92.04 -100.88, 18.77 306.82, 91.94 -55.24, -29.66 in-in in 8.5226 Saltbr-in 2.7409 HRD-in -79.01, -43.93 67.99, -8.85 in-in-in SNCiii in-in ActLoopNT-in 2.8557 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -69.22, 143.85 APE9-dihe-na 143.4, 155.54 APE8-dihe-in -77.65, 123.56 APE8-rot-in 291.78 APE67-dihe-inflip 80.21, 1.47 -53.68, 143.02 APE12-dist-in 9.0778 APE11-dist-in 11.7091 APE10-dist-in 5.6489 APE9-dist-in 3.3733 None None None AF2 -1.0 1.0 1.0 A 276.0 276.0 0 26 26 0 [[1875, 2134]] 1.0 AF-Q5S007-K1 Homo sapiens TKL_LRRK2_HUMAN TKL 3.4e-59 206.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN AF-Q5S007-K3A Q5S007 1867 2142 2527.0 No_ligand No_ligand Active DFGin 6.328 13.3987 BLAminus -133.98, -172.94 51.72, 69.61 -85.29, 16.73 308.68, 103.46 -56.98, -31.93 in-in in 8.3926 Saltbr-in 2.7668 HRD-in -86.23, -45.15 69.51, -3.36 in-in-in SNCiii in-in ActLoopNT-in 2.8818 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -81.61, 122.15 APE9-dihe-na 162.76, 154.5 APE8-dihe-in -73.2, 129.38 APE8-rot-in 298.65 APE67-dihe-inflip 69.21, 15.98 -53.32, 138.33 APE12-dist-in 9.2299 APE11-dist-in 11.9129 APE10-dist-in 5.9109 APE9-dist-in 3.4313 None None None AF2 -1.0 1.0 1.0 A 276.0 276.0 0 26 26 0 [[1875, 2134]] 1.0 AF-Q5S007-K3 Homo sapiens TKL_LRRK2_HUMAN TKL 3.4e-59 206.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TXZA Q5S007 1334 2522 2527.0 A1N:2601 Type1 Active DFGin 5.902 13.0948 BLAminus -119.85, -169.49 50.07, 80.97 -87.42, 36.51 309.72, 108.58 -60.32, -41.76 in-in in 8.2367 Saltbr-in 2.6912 HRD-in -80.74, -21.83 59.24, -43.27 in-in-in SNCiii in-in ActLoopNT-in 3.0983 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -129.73, 163.14 APE9-dihe-na 133.8, 147.92 APE8-dihe-in -71.53, 133.95 APE8-rot-in 307.22 APE67-dihe-inflip 87.19, -6.79 -58.87, 140.06 APE12-dist-in 9.3457 APE11-dist-in 10.9548 APE10-dist-in 5.5272 APE9-dist-in 4.2857 None None None EM 3.05 999.0 999.0 A 1194.0 858.0 2 26 26 0 [[1875, 2134]] 1.0 8txz Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U7HC Q5S007 1329 2527 2527.0 A0T:2602 Type1 Active DFGin 6.6983 13.8151 BLAminus -151.89, 162.68 84.4, 53.96 -82.18, 68.13 318.52, 92.12 -89.42, -24.81 in-in in 8.7166 Saltbr-in 2.9911 HRD-in -80.66, -50.67 74.5, -8.1 in-in-in SNCiii in-in ActLoopNT-in 3.1994 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -120.02, 135.14 APE9-dihe-na 174.93, 137.62 APE8-dihe-in -66.66, 127.94 APE8-rot-in 301.78 APE67-dihe-inflip 117.57, -20.5 -57.74, 115.44 APE12-dist-in 9.2479 APE11-dist-in 11.8898 APE10-dist-in 6.338 APE9-dist-in 4.3411 None None None EM 3.8 999.0 999.0 C 1201.0 1111.0 0 26 26 0 [[1875, 2134]] 1.0 8u7h Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZCA Q5S007 1333 2522 2527.0 A1N:2601 Type1 Active DFGin 6.0408 13.1072 BLAminus -134.37, -169.11 59.32, 67.24 -87.67, 29.16 308.05, 110.26 -61.86, -42.21 in-in in 8.1259 Saltbr-in 2.6349 HRD-in -84.6, -55.91 75.29, -7.67 in-in-in SNCiii in-in ActLoopNT-in 3.233 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.26, 150.23 APE9-dihe-na 145.44, 148.58 APE8-dihe-in -73.74, 131.69 APE8-rot-in 285.07 APE67-dihe-inflip 88.6, -3.69 -59.24, 141.32 APE12-dist-in 9.0561 APE11-dist-in 11.2243 APE10-dist-in 5.5315 APE9-dist-in 3.5704 G2019S None None EM 2.7 999.0 999.0 A 1195.0 872.0 9 26 26 0 [[1875, 2134]] 1.0 8tzc Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-56 198.4 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8SMCC Q5S007 1329 2527 2527.0 TVT:2602 Type1 Inactive DFGin 6.2551 14.331 BLAminus -151.88, 173.9 60.74, 67.04 -79.23, 54.05 290.31, 81.86 -72.94, -29.2 in-out in 8.7531 Saltbr-out 4.1538 HRD-in -106.77, -45.45 59.98, 13.21 out-in-out SNCoio in-out ActLoopNT-in 3.2443 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -134.51, -171.55 APE9-dihe-na 124.76, -144.62 APE8-dihe-in -154.79, 139.07 APE8-rot-out 178.61 APE67-dihe-inflip 104.6, -41.0 -57.79, 132.46 APE12-dist-in 9.701 APE11-dist-in 11.7459 APE10-dist-in 6.3147 APE9-dist-in 3.8159 None None None EM 4.02 999.0 999.0 C 1201.0 1084.0 0 26 26 0 [[1875, 2134]] 1.0 8smc Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO7C Q5S007 1329 2527 2527.0 4K4:2602 Type1 Inactive DFGin 6.3123 13.4308 BLAminus -139.62, -172.17 59.51, 63.49 -84.43, 55.49 307.71, 102.06 -84.67, -29.66 in-out in 8.394 Saltbr-out 4.3555 HRD-in -101.09, -54.55 67.14, -1.83 out-in-in SNCoii in-in ActLoopNT-in 3.1219 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -71.0, 153.99 APE9-dihe-na 157.61, -174.98 APE8-dihe-in -111.39, 127.24 APE8-rot-in 309.15 APE67-dihe-inflip 92.52, -18.58 -59.81, 139.65 APE12-dist-in 9.0942 APE11-dist-in 11.5555 APE10-dist-in 5.6425 APE9-dist-in 3.801 None None None EM 3.52 999.0 999.0 C 1201.0 1141.0 0 26 26 0 [[1875, 2134]] 1.0 8fo7 Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZGA Q5S007 1333 2522 2527.0 A1N:2601 Type1 Inactive DFGin 6.3599 13.2865 BLAminus -134.51, -172.26 58.22, 65.93 -89.73, 27.97 304.01, 111.0 -72.25, -10.98 in-out in 8.0479 Saltbr-out 4.6418 HRD-in -83.84, -36.4 70.02, -7.06 out-in-in SNCoii in-in ActLoopNT-in 2.9835 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.38, 154.59 APE9-dihe-na 133.01, 150.21 APE8-dihe-in -76.98, 130.91 APE8-rot-in 304.9 APE67-dihe-inflip 102.2, -9.16 -57.75, 128.19 APE12-dist-in 9.9536 APE11-dist-in 11.0137 APE10-dist-in 5.2931 APE9-dist-in 3.5709 I2020T None None EM 2.7 999.0 999.0 A 1190.0 906.0 2 26 26 0 [[1875, 2134]] 1.0 8tzg Homo sapiens TKL_LRRK2_HUMAN TKL 2.3e-57 200.9 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 6VP8A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1491 13.5381 BLBplus -81.68, 148.11 43.57, 50.62 -72.43, 158.92 54.89, 92.79 125.38, 999.0 in-out in 7.9447 Saltbr-out 5.2252 HRD-in -73.85, -48.07 61.91, 23.91 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.13, 77.73 999.0, -140.5 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1198.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp8 Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 6VNOA Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1612 13.542 BLBplus -82.18, 148.25 43.35, 49.88 -75.1, 158.85 56.03, 91.04 126.75, 999.0 in-out in 7.9447 Saltbr-out 5.2208 HRD-in -73.59, -47.59 62.0, 23.37 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vno Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 6VP6A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1612 13.542 BLBplus -81.71, 148.21 43.95, 50.5 -72.87, 159.16 54.85, 89.9 125.39, 999.0 in-out in 7.9447 Saltbr-out 5.2208 HRD-in -75.0, -48.38 61.49, 26.99 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.47 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp6 Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 6VP7A Q5S007 1330 2525 2527.0 No_ligand No_ligand Inactive DFGin 5.1485 13.5379 BLBplus -81.78, 147.88 44.05, 50.71 -72.61, 159.21 55.02, 89.94 124.84, 999.0 in-out in 7.9447 Saltbr-out 5.2255 HRD-in -73.43, -46.88 69.56, 9.74 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -89.14, 77.74 999.0, -140.53 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None TPO1343 TPO1343 EM 3.5 999.0 999.0 A 1201.0 1084.0 16 26 10 16 [[1875, 2134]] 1.0 6vp7 Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZHA Q5S007 627 2522 2527.0 A1N:2601 Type1 Inactive DFGin 5.1887 13.0236 None -82.7, -162.66 -41.82, 136.94 -146.23, 112.92 28.36, 40.7 -50.64, 999.0 in-out in 9.2107 Saltbr-out 4.5645 HRD-in -114.23, -59.07 54.02, 31.73 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiii APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -53.84 APE8-dihe-in -145.38, 140.36 APE8-rot-in 326.06 APE67-dihe-in -90.26, -10.83 -64.13, -43.14 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.2169 None None None EM 3.9 999.0 999.0 A 2527.0 1485.0 21 26 12 14 [[1875, 2134]] 1.0 8tzh Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 9CHOA Q5S007 543 2527 2527.0 A1N:2701 Type1 Inactive DFGin 6.0139 12.2545 None -87.37, -156.77 -42.12, 141.81 -109.94, -179.33 314.03, 99.42 -59.72, 999.0 in-out in 9.1584 Saltbr-out 5.5545 HRD-in -73.99, -50.39 47.44, 27.45 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiii APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -45.86 APE8-dihe-in -153.53, 148.49 APE8-rot-in 317.08 APE67-dihe-in -67.05, -9.98 -58.64, -41.45 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.7475 I2020T None None EM 7.8 999.0 999.0 A 1985.0 1792.0 21 26 12 14 [[1875, 2134]] 1.0 9cho Homo sapiens TKL_LRRK2_HUMAN TKL 4.9e-57 199.8 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 7LHTA Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8435 8.2947 None -64.84, 122.35 -98.75, -0.04 -71.37, -28.28 172.84, 65.91 -59.04, -42.88 out-out out 11.1561 Saltbr-out 7.8414 HRD-in -69.75, -40.92 72.72, -9.61 out-out-out SNCooo out-out ActLoopNT-out 9.7836 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.21, -17.19 APE9-dihe-na 90.26, 154.46 APE8-dihe-in -57.7, 141.99 APE8-rot-in 318.57 APE67-dihe-in -63.97, -43.36 -55.36, -52.39 APE12-dist-in 9.6726 APE11-dist-in 10.1449 APE10-dist-out 14.0961 APE9-dist-in 4.0969 None None None EM 3.5 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7lht Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 7LHTB Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8435 8.2947 None -64.86, 122.35 -98.72, -0.04 -71.37, -28.3 172.84, 65.9 -59.09, -42.88 out-out out 11.1564 Saltbr-out 7.8415 HRD-in -69.81, -40.92 72.73, -9.55 out-out-out SNCooo out-out ActLoopNT-out 9.783 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.22, -17.15 APE9-dihe-na 90.23, 154.47 APE8-dihe-in -57.69, 142.03 APE8-rot-in 318.55 APE67-dihe-in -64.0, -43.36 -55.37, -52.4 APE12-dist-in 9.6725 APE11-dist-in 10.1447 APE10-dist-out 14.096 APE9-dist-in 4.0969 None None None EM 3.5 999.0 999.0 B 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7lht Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 7LHWA Q5S007 540 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.3492 8.2774 None -70.88, 117.76 -93.02, 2.5 -63.92, -24.19 170.47, 59.39 -60.34, -43.84 out-out out 10.98 Saltbr-out 7.2575 HRD-in -74.65, -33.87 72.74, -12.12 out-out-out SNCooo out-out ActLoopNT-out 9.6308 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -74.42, -8.25 APE9-dihe-na 81.17, 153.49 APE8-dihe-in -58.6, 142.93 APE8-rot-in 304.43 APE67-dihe-in -63.74, -43.48 -51.59, -53.96 APE12-dist-in 10.2362 APE11-dist-in 9.4572 APE10-dist-out 13.8716 APE9-dist-in 4.3352 None None None EM 3.7 999.0 999.0 A 2527.0 1813.0 3 26 23 3 [[1875, 2134]] 1.0 7lhw Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 7LI4A Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.8442 8.2944 None -64.77, 122.33 -98.76, -0.03 -71.41, -28.21 172.83, 65.95 -59.02, -42.88 out-out out 11.1566 Saltbr-out 7.8416 HRD-in -69.78, -40.92 72.72, -9.67 out-out-out SNCooo out-out ActLoopNT-out 9.7838 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -82.19, -17.19 APE9-dihe-na 90.26, 154.48 APE8-dihe-in -57.73, 142.01 APE8-rot-in 318.58 APE67-dihe-in -63.98, -43.36 -55.36, -52.38 APE12-dist-in 9.6727 APE11-dist-in 10.1448 APE10-dist-out 14.0958 APE9-dist-in 4.0959 None None None EM 3.1 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7li4 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO2E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.5492 8.1829 None -77.97, 115.31 -99.8, 16.1 -71.24, -24.34 179.0, 61.54 -64.41, -41.78 out-out out 11.347 Saltbr-out 7.8505 HRD-in -73.2, -35.27 72.81, -10.29 out-out-out SNCooo out-out ActLoopNT-out 9.492 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.29, -18.03 APE9-dihe-na 75.0, 160.57 APE8-dihe-in -64.56, 133.01 APE8-rot-in 300.63 APE67-dihe-in -63.84, -35.14 -59.88, -35.03 APE12-dist-in 9.1186 APE11-dist-in 10.5881 APE10-dist-out 14.4472 APE9-dist-in 4.3818 None None None EM 4.13 999.0 999.0 E 2527.0 2275.0 4 26 23 3 [[1875, 2134]] 1.0 8fo2 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO8C Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.4041 8.3667 None -77.76, 115.2 -99.79, 16.57 -70.68, -24.12 178.89, 61.58 -64.22, -41.72 out-out out 11.3412 Saltbr-out 7.7439 HRD-in -73.07, -35.29 72.76, -10.32 out-out-out SNCooo out-out ActLoopNT-out 9.4707 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.5, -18.26 APE9-dihe-na 74.89, 160.43 APE8-dihe-in -64.77, 133.4 APE8-rot-in 300.66 APE67-dihe-in -63.6, -35.05 -59.67, -34.64 APE12-dist-in 9.0713 APE11-dist-in 10.5217 APE10-dist-out 14.4112 APE9-dist-in 4.4488 None None None EM 3.88 999.0 999.0 C 2527.0 2270.0 4 26 23 3 [[1875, 2134]] 1.0 8fo8 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO8E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 10.4146 8.3493 None -77.68, 115.13 -99.83, 16.55 -70.64, -24.07 178.91, 61.52 -64.18, -41.73 out-out out 11.3208 Saltbr-out 7.7298 HRD-in -73.0, -35.27 72.87, -10.42 out-out-out SNCooo out-out ActLoopNT-out 9.4702 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -67.4, -18.35 APE9-dihe-na 74.93, 160.44 APE8-dihe-in -64.61, 133.34 APE8-rot-in 300.72 APE67-dihe-in -63.56, -35.05 -59.56, -34.8 APE12-dist-in 9.056 APE11-dist-in 10.5258 APE10-dist-out 14.406 APE9-dist-in 4.4342 None None None EM 3.88 999.0 999.0 E 2527.0 2270.0 4 26 23 3 [[1875, 2134]] 1.0 8fo8 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO9F Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.3478 8.5752 None -68.36, 152.72 -137.53, 18.95 -81.54, -22.77 187.88, 51.61 -70.19, -36.74 out-out out 11.2379 Saltbr-out 8.3264 HRD-in -76.93, -42.26 72.06, -11.17 out-out-out SNCooo out-out ActLoopNT-out 9.1058 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -70.82, -18.07 APE9-dihe-na 87.94, 175.98 APE8-dihe-in -63.48, 135.16 APE8-rot-in 300.23 APE67-dihe-in -66.37, -45.6 -58.88, -37.04 APE12-dist-in 9.7177 APE11-dist-in 10.5775 APE10-dist-out 14.122 APE9-dist-in 4.4728 None None None EM 3.48 999.0 999.0 F 2527.0 2289.0 3 26 23 3 [[1875, 2134]] 1.0 8fo9 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8VH5A Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive DFGinter 9.7464 8.455 None -88.01, 106.84 -81.35, 17.64 -78.83, -10.5 197.42, 64.93 -68.71, -22.79 out-out out 11.3256 Saltbr-out 8.1229 HRD-in -105.05, -49.61 72.56, -5.72 out-out-out SNCooo out-out ActLoopNT-out 8.9614 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -67.06, -23.38 APE9-dihe-na 73.72, 168.0 APE8-dihe-in -68.8, 143.98 APE8-rot-out 58.99 APE67-dihe-in -65.74, -54.3 -73.05, -29.17 APE12-dist-in 9.6328 APE11-dist-in 8.4163 APE10-dist-out 13.3438 APE9-dist-in 3.8609 None None None EM 4.0 999.0 999.0 A 2527.0 2221.0 8 26 18 8 [[1875, 2134]] 1.0 8vh5 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8VH5C Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive DFGinter 9.746 8.4552 None -88.01, 106.86 -81.36, 17.7 -78.84, -10.6 197.4, 64.92 -68.66, -22.76 out-out out 11.3253 Saltbr-out 8.1217 HRD-in -104.99, -49.63 72.52, -5.67 out-out-out SNCooo out-out ActLoopNT-out 8.9613 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -66.98, -23.42 APE9-dihe-na 73.64, 168.02 APE8-dihe-in -68.73, 143.93 APE8-rot-out 59.0 APE67-dihe-in -65.76, -54.24 -73.07, -29.13 APE12-dist-in 9.6328 APE11-dist-in 8.4176 APE10-dist-out 13.3446 APE9-dist-in 3.8618 None None None EM 4.0 999.0 999.0 C 2527.0 2221.0 8 26 18 8 [[1875, 2134]] 1.0 8vh5 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 7LI3A Q5S007 558 2527 2527.0 ATP:2602 ATPlike Inactive DFGinter 9.5831 8.4031 None -64.7, 121.5 -105.97, 8.82 -69.04, -26.41 175.66, 65.26 -63.25, -46.61 out-out out 11.4013 Saltbr-out 8.1206 HRD-in -76.04, -34.97 73.14, -12.04 out-out-out SNCooo out-out ActLoopNT-out 9.6644 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -85.32, -9.76 APE9-dihe-na 87.27, 160.92 APE8-dihe-in -56.79, 143.13 APE8-rot-in 300.33 APE67-dihe-in -63.35, -39.62 -56.92, -55.07 APE12-dist-in 10.3855 APE11-dist-in 10.3625 APE10-dist-out 14.0058 APE9-dist-in 3.6521 None None None EM 3.8 999.0 999.0 A 2527.0 1795.0 3 26 23 3 [[1875, 2134]] 1.0 7li3 Homo sapiens TKL_LRRK2_HUMAN TKL 3.9e-56 197.0 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 9CI3A Q5S007 907 2527 2527.0 No_ligand No_ligand Inactive DFGinter 10.474 8.2787 None -66.48, 130.02 -90.44, 1.88 -71.41, -23.46 187.57, 71.09 -65.75, -44.61 out-out out 11.2241 Saltbr-out 6.8631 HRD-in -66.49, -44.27 66.72, -4.67 out-out-out SNCooo out-out ActLoopNT-out 9.4202 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -69.6, -18.48 APE9-dihe-na 81.06, 161.8 APE8-dihe-in -67.87, 131.88 APE8-rot-in 311.06 APE67-dihe-in -65.99, -44.62 -57.57, -36.48 APE12-dist-in 9.7404 APE11-dist-in 9.3201 APE10-dist-out 13.7805 APE9-dist-in 4.5479 None SEP910,SEP935 SEP910,SEP935 EM 3.96 999.0 999.0 A 2562.0 1521.0 3 26 23 3 [[1875, 2134]] 1.0 9ci3 Homo sapiens TKL_LRRK2_HUMAN TKL 3.9e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZBA Q5S007 1334 2522 2527.0 T3X:2601 Type2 Inactive DFGout 14.0658 10.7664 BBAminus -132.66, 154.43 -138.45, 96.4 -87.4, 60.9 334.47, 86.31 57.59, 999.0 in-out in 9.0019 Saltbr-out 5.5404 HRD-out -73.84, 143.19 -69.19, -64.34 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -72.6, -22.58 999.0, -105.88 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 3.1 999.0 999.0 A 2527.0 920.0 40 26 10 16 [[1875, 2134]] 1.0 8tzb Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U7LA Q5S007 558 2526 2527.0 T3X:2602 Type2 Inactive DFGout 14.9805 11.008 BBAminus -140.78, 146.38 -122.43, 95.19 -64.85, -14.51 319.76, 127.29 74.72, 24.72 in-out in 9.1479 Saltbr-out 3.8691 HRD-out -74.43, 79.23 -48.3, -61.63 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.46 APE8-dihe-in -63.34, 144.64 APE8-rot-none 999.0 APE67-dihe-in -74.67, -26.35 -63.34, -33.42 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.8338 None None None EM 3.6 999.0 999.0 A 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u7l Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U7LB Q5S007 558 2526 2527.0 T3X:2602 Type2 Inactive DFGout 14.984 11.014 BBAminus -140.53, 146.5 -122.41, 95.28 -64.83, -14.47 319.94, 127.4 74.7, 24.71 in-out in 9.1791 Saltbr-out 3.946 HRD-out -74.52, 79.38 -48.22, -61.54 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaini APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.39 APE8-dihe-in -63.16, 144.49 APE8-rot-none 999.0 APE67-dihe-in -74.6, -26.44 -63.18, -33.64 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.8475 None None None EM 3.6 999.0 999.0 B 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u7l Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U8AB Q5S007 558 2526 2527.0 0LI:2601 Type2 Inactive DFGout 14.859 10.8454 BBAminus -150.37, 144.32 -124.19, 97.68 -69.79, -11.11 321.73, 111.63 66.57, 27.33 in-out in 8.8739 Saltbr-out 3.6727 HRD-out -76.07, 95.41 -48.17, -63.17 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.03 APE8-dihe-in -61.6, 136.03 APE8-rot-in 305.18 APE67-dihe-in -74.33, -25.33 -56.72, -44.14 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.2972 None None None EM 3.4 999.0 999.0 B 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u8a Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U8AC Q5S007 558 2526 2527.0 0LI:2601 Type2 Inactive DFGout 14.8696 10.8459 BBAminus -150.46, 144.31 -124.23, 97.69 -69.77, -11.06 321.78, 111.5 66.48, 27.35 in-out in 8.8719 Saltbr-out 3.6608 HRD-out -76.02, 95.48 -48.33, -63.13 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 177.01 APE8-dihe-in -61.57, 135.98 APE8-rot-in 305.14 APE67-dihe-in -74.37, -25.35 -56.73, -44.17 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 6.3006 None None None EM 3.4 999.0 999.0 C 2527.0 1705.0 29 26 13 13 [[1875, 2134]] 1.0 8u8a Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U8BA Q5S007 558 2527 2527.0 919:2602 Type2 Inactive DFGout 14.9848 10.7673 BBAminus -149.25, 136.17 -99.76, 91.29 -52.15, -10.61 276.36, 113.64 76.74, 3.44 in-out in 9.1775 Saltbr-out 4.7045 HRD-out -74.73, -14.63 57.07, -112.57 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -110.86 APE8-dihe-in -64.22, 146.58 APE8-rot-out 61.38 APE67-dihe-in -67.91, -38.53 -58.15, -35.54 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 7.1562 None None None EM 3.7 999.0 999.0 A 2527.0 1712.0 29 26 13 13 [[1875, 2134]] 1.0 8u8b Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U8BB Q5S007 558 2527 2527.0 919:2602 Type2 Inactive DFGout 15.1337 10.7613 BBAminus -149.27, 136.01 -99.86, 91.22 -52.2, -10.44 276.32, 113.8 76.86, 3.6 in-out in 9.1521 Saltbr-out 4.659 HRD-out -74.69, -14.68 57.08, -112.62 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -110.92 APE8-dihe-in -64.16, 146.68 APE8-rot-out 61.4 APE67-dihe-in -67.92, -38.48 -58.09, -35.58 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 7.1489 None None None EM 3.7 999.0 999.0 B 2527.0 1712.0 29 26 13 13 [[1875, 2134]] 1.0 8u8b Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TYQA Q5S007 1335 2525 2527.0 T3X:2601 Type2 Inactive DFGout 14.3305 11.0592 BBAminus -137.54, 169.5 -145.41, 104.05 -82.78, -8.0 323.29, 109.83 55.65, 41.77 in-out in 9.3025 Saltbr-out 3.848 HRD-out 58.33, 70.16 -50.78, -51.1 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 93.28, -8.85 999.0, 38.74 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 G2019S None None EM 2.99 999.0 999.0 A 2527.0 957.0 45 26 11 15 [[1875, 2134]] 1.0 8tyq Homo sapiens TKL_LRRK2_HUMAN TKL 3.9e-56 197.0 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8FO9E Q5S007 12 2527 2527.0 ATP:2602 ATPlike Inactive DFGout 11.3745 7.913 None -68.54, 152.71 -137.53, 21.65 -90.85, -9.64 146.2, 91.59 -82.02, -36.47 out-out out 11.1602 Saltbr-out 8.209 HRD-in -76.97, -42.35 72.15, -11.11 out-out-out SNCooo out-out ActLoopNT-out 9.123 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioi APE10-dihe-na -70.77, -18.05 APE9-dihe-na 87.91, 175.95 APE8-dihe-in -63.49, 135.16 APE8-rot-in 300.24 APE67-dihe-in -66.44, -45.65 -58.78, -37.14 APE12-dist-in 9.6513 APE11-dist-in 10.5523 APE10-dist-out 14.083 APE9-dist-in 4.472 None None None EM 3.48 999.0 999.0 E 2527.0 2287.0 3 26 23 3 [[1875, 2134]] 1.0 8fo9 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 9DMIA Q5S007 1334 2526 2527.0 A1A7Q:2601 Type2 Inactive DFGout 15.84 8.13 None -143.34, 124.58 -90.2, 120.11 -102.11, 113.17 183.37, 75.07 -64.73, -43.31 in-out in 9.1947 Saltbr-out 5.7228 HRD-out -85.28, 107.16 -59.63, -51.47 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoi APE10-dihe-na 999.0, -16.67 APE9-dihe-na 132.14, 155.57 APE8-dihe-in -70.08, 157.55 APE8-rot-out 60.86 APE67-dihe-in -127.81, 0.85 -71.06, 7.57 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 13.1144 APE9-dist-in 5.003 None None None EM 3.35 999.0 999.0 A 1195.0 933.0 37 26 14 12 [[1875, 2134]] 1.0 9dmi Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZEA Q5S007 1624 2522 2527.0 T3X:2601 Type2 Inactive DFGout 14.7864 11.433 None -133.1, 147.85 -126.11, 97.45 -74.36, -179.05 327.53, 107.99 -78.96, -62.34 in-in in 8.3878 Saltbr-in 3.1059 HRD-out -92.7, 99.94 -63.72, -48.22 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -86.92, 6.14 999.0, -117.5 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 2.9 999.0 999.0 A 2527.0 787.0 35 26 11 15 [[1875, 2134]] 1.0 8tze Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8TZFA Q5S007 587 2522 2527.0 T3X:2602 Type2 Inactive DFGout 14.7857 9.9994 None -152.73, 148.88 -147.21, 93.65 -77.45, 164.4 333.33, 110.23 -85.3, -156.36 in-in in 8.8618 Saltbr-in 2.8693 HRD-out -76.29, 155.16 -83.05, -63.93 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -77.21, -21.56 999.0, -134.97 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 I2020T None None EM 3.4 999.0 999.0 A 2527.0 1589.0 24 26 11 15 [[1875, 2134]] 1.0 8tzf Homo sapiens TKL_LRRK2_HUMAN TKL 6.8e-57 199.5 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8VH4A Q5S007 12 2527 2527.0 ANP:2602 ATPlike Inactive None 999.0 999.0 None -94.14, 87.28 -74.17, 5.0 -60.35, -20.37 999.0, 999.0 -59.12, -33.8 out-none out 12.056 Saltbr-none 999.0 HRD-in -102.88, -51.08 73.15, -5.33 none-out-out SNCnoo out-out ActLoopNT-out 8.7502 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioi APE10-dihe-na -76.21, -33.07 APE9-dihe-na 74.7, 171.21 APE8-dihe-in -59.82, 149.42 APE8-rot-out 184.58 APE67-dihe-in -66.4, -59.35 -67.96, -43.48 APE12-dist-in 10.2221 APE11-dist-in 9.4484 APE10-dist-out 13.4907 APE9-dist-in 4.0567 None None None EM 4.1 999.0 999.0 A 2527.0 2235.0 8 26 18 8 [[1875, 2134]] 1.0 8vh4 Homo sapiens TKL_LRRK2_HUMAN TKL 3.8e-57 200.3 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2
LRRK2 LRRK2_HUMAN 8U1BA Q5S007 1952 2521 2527.0 No_ligand No_ligand Inactive None 999.0 999.0 None 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 none-none none 999.0 Saltbr-none 999.0 HRD-in -114.83, -57.08 66.3, -2.18 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 999.0, 999.0 999.0, 999.0 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None EM 3.7 999.0 999.0 A 1194.0 461.0 124 26 0 26 [[1875, 2134]] 1.0 8u1b Homo sapiens TKL_LRRK2_HUMAN TKL 1.3e-57 201.7 5.0 266.0 262.0 2016 2017 2018 2020 2022 1906 1920 1924 1991 1993 1992 1994.0 2055 2042 2037 2036 2035 2034 2033 2032 2031 1948 Leucine-rich repeat serine/threonine-protein kinase 2

TKL_LRRK2 (Leucine-rich repeat serine/threonine-protein kinase 2)

Total number of chains: 0
Active chains: 0
Spatial label Dihedral label Number of Chains Percent Representative

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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