CAMK_CAMKK2 (Calcium/calmodulin-dependent protein kinase kinase 2)

Total number of chains: 21
Active chains: 20
Family: CAMK
Uniprot: KKCC2_HUMAN
Kinase Domain Residues: 165 - 446
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 21 100.0% AF-Q96RR4-K1A

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PDB 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
AF-Q96RR4-K1A 157 454 588.0 No_ligand No_ligand Active DFGin 6.665 14.169 BLAminus -132.44, 175.99 57.36, 68.16 -76.57, 14.76 286.1, 81.79 -62.55, -23.22 in-in in 9.394 Saltbr-in 2.695 HRD-in -79.64, -48.25 68.82, -0.98 in-in-in SNCiii in-in ActLoopNT-in 2.951 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.01, 169.11 APE9-dihe-na 104.28, -176.67 APE8-dihe-in -78.12, 125.37 APE8-rot-in 303.5 APE67-dihe-in -69.04, -13.45 -51.83, -41.76 APE12-dist-in 10.041 APE11-dist-in 11.409 APE10-dist-in 5.575 APE9-dist-in 3.675 None None None AF2 -1.0 1.0 1.0 A 298 298 0 0 0 0 [[165, 446]] 1.0 AF-Q96RR4-K1 CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
AF-Q96RR4-K3A 157 454 588.0 No_ligand No_ligand Active DFGin 6.467 14.428 BLAminus -128.41, 174.74 57.05, 81.6 -88.18, 14.62 288.81, 81.28 -63.4, -16.07 in-in in 9.319 Saltbr-in 2.712 HRD-in -77.71, -48.64 72.76, -3.48 in-in-in SNCiii in-in ActLoopNT-in 2.948 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.55, 162.31 APE9-dihe-na 106.94, -168.52 APE8-dihe-in -85.81, 124.48 APE8-rot-in 304.61 APE67-dihe-in -68.71, -15.46 -52.27, -41.23 APE12-dist-in 9.83 APE11-dist-in 11.286 APE10-dist-in 5.521 APE9-dist-in 3.906 None None None AF2 -1.0 1.0 1.0 A 298 298 0 0 0 0 [[165, 446]] 1.0 AF-Q96RR4-K3 CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6CMJA 161 463 588.0 F6J:60501 Type1 Active DFGin 6.701 14.021 BLAminus -128.16, 173.53 66.84, 86.55 -100.45, 21.53 286.63, 76.45 -58.11, -34.47 in-in in 9.516 Saltbr-in 2.708 HRD-in -70.27, -50.6 73.87, 2.96 in-in-in SNCiii in-in ActLoopNT-in 2.948 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.24, 163.41 APE9-dihe-na 103.64, -157.45 APE8-dihe-in -90.88, 126.33 APE8-rot-in 303.07 APE67-dihe-in -67.03, -16.03 -51.77, -42.09 APE12-dist-in 9.98 APE11-dist-in 11.134 APE10-dist-in 5.259 APE9-dist-in 3.817 None SEP345,SEP400,TPO462 SEP345,SEP400,TPO462 XRAY 2.4 0.184 0.219 A 321 288 0 0 0 0 [[165, 446]] 1.0 6cmj CAMK_CAMKK2_HUMAN CAMK 2.4e-75 259.1 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6CMJB 161 462 588.0 F6J:60501 Type1 Active DFGin 6.554 14.022 BLAminus -126.23, 173.65 67.8, 86.78 -100.71, 20.95 284.77, 76.92 -57.77, -33.94 in-in in 9.471 Saltbr-in 2.703 HRD-in -69.56, -50.79 72.39, 3.04 in-in-in SNCiii in-in ActLoopNT-in 2.937 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.14, 163.72 APE9-dihe-na 103.15, -157.71 APE8-dihe-in -91.26, 126.78 APE8-rot-in 302.39 APE67-dihe-in -66.21, -16.47 -51.31, -43.01 APE12-dist-in 9.849 APE11-dist-in 11.082 APE10-dist-in 5.224 APE9-dist-in 3.82 None SEP345,SEP400,TPO462 SEP345,SEP400,TPO462 XRAY 2.4 0.184 0.219 B 321 287 0 0 0 0 [[165, 446]] 1.0 6cmj CAMK_CAMKK2_HUMAN CAMK 2.4e-75 259.1 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5UY6A 161 448 588.0 8R4:60501 Type1 Active DFGin 6.658 14.113 BLAminus -132.25, 178.64 58.27, 80.64 -92.28, 18.22 280.67, 75.88 -55.42, -33.9 in-in in 9.414 Saltbr-in 2.807 HRD-in -79.1, -48.26 75.47, 2.11 in-in-in SNCiii in-in ActLoopNT-in 2.949 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -105.81, 164.34 APE9-dihe-na 164.84, 175.43 APE8-dihe-in -85.88, 125.38 APE8-rot-in 293.83 APE67-dihe-in -66.95, -13.04 -45.29, -49.63 APE12-dist-in 12.905 APE11-dist-in 9.434 APE10-dist-in 5.805 APE9-dist-in 3.699 None None None XRAY 1.7 0.161 0.182 A 291 280 8 0 0 0 [[165, 446]] 1.0 5uy6 CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5UYJA 161 449 588.0 8R7:60501 Type1 Active DFGin 6.677 14.259 BLAminus -132.08, 177.07 61.37, 75.95 -92.03, 18.28 280.27, 75.86 -52.8, -33.56 in-in in 9.609 Saltbr-in 2.819 HRD-in -81.51, -46.94 74.7, -2.01 in-in-in SNCiii in-in ActLoopNT-in 2.923 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -95.8, 177.18 APE9-dihe-na 146.73, 172.64 APE8-dihe-in -82.87, 120.29 APE8-rot-in 300.04 APE67-dihe-in -68.29, -15.78 -49.75, -38.95 APE12-dist-in 13.135 APE11-dist-in 9.542 APE10-dist-in 5.877 APE9-dist-in 3.8 None None None XRAY 1.6 0.154 0.171 A 291 279 10 0 0 0 [[165, 446]] 1.0 5uyj CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5VT1A 161 448 588.0 9JS:60501 Type1 Active DFGin 6.546 15.55 BLAminus -132.63, 175.89 60.91, 78.93 -96.17, 18.34 289.68, 79.81 -58.68, -37.7 in-in in 9.551 Saltbr-in 2.749 HRD-in -65.51, -51.56 73.13, -0.26 in-in-in SNCiii in-in ActLoopNT-in 2.771 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.36, 161.23 APE9-dihe-na 117.82, -160.36 APE8-dihe-in -95.25, 124.59 APE8-rot-in 296.31 APE67-dihe-in -61.09, -17.48 -48.27, -47.93 APE12-dist-in 9.741 APE11-dist-in 11.275 APE10-dist-in 5.375 APE9-dist-in 3.72 None None None XRAY 1.9 0.162 0.185 A 291 264 24 0 0 0 [[165, 446]] 1.0 5vt1 CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BKUA 162 448 588.0 DXV:60501 Type1 Active DFGin 6.671 13.993 BLAminus -127.33, 174.32 63.79, 82.42 -93.37, 15.83 286.48, 75.23 -60.79, -22.1 in-in in 9.376 Saltbr-in 2.778 HRD-in -78.88, -49.79 72.64, 5.62 in-in-in SNCiii in-in ActLoopNT-in 2.87 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -109.85, 136.95 APE9-dihe-na -173.19, 179.59 APE8-dihe-in -86.46, 122.73 APE8-rot-in 300.93 APE67-dihe-in -60.17, -23.84 -48.28, -46.85 APE12-dist-in 12.68 APE11-dist-in 9.268 APE10-dist-in 5.511 APE9-dist-in 3.673 None None None XRAY 2.0 0.195 0.237 A 291 264 23 0 0 0 [[165, 446]] 1.0 6bku CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BLEA 161 448 588.0 34U:60501 Type1 Active DFGin 6.944 13.935 BLAminus -128.26, 170.03 71.11, 85.91 -96.22, 21.85 288.46, 75.34 -64.75, -26.18 in-in in 9.44 Saltbr-in 2.979 HRD-in -71.71, -49.79 72.3, -0.91 in-in-in SNCiii in-in ActLoopNT-in 2.791 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -134.97, 170.59 APE9-dihe-na 108.12, -153.2 APE8-dihe-in -104.48, 120.4 APE8-rot-in 301.26 APE67-dihe-in -69.03, -15.32 -42.71, -45.39 APE12-dist-in 9.752 APE11-dist-in 11.249 APE10-dist-in 5.436 APE9-dist-in 3.784 None None None XRAY 1.9 0.188 0.227 A 291 263 25 0 0 0 [[165, 446]] 1.0 6ble CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BQLA 161 448 588.0 BI9:60501 Type1 Active DFGin 6.775 15.905 BLAminus -125.08, 172.02 71.12, 81.11 -96.1, 13.43 287.91, 80.94 -58.33, -35.96 in-in in 9.654 Saltbr-in 3.536 HRD-in -69.05, -49.88 71.03, 0.77 in-in-in SNCiii in-in ActLoopNT-in 2.758 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -135.45, 168.13 APE9-dihe-na 102.75, -153.47 APE8-dihe-in -100.87, 121.4 APE8-rot-in 299.55 APE67-dihe-in -62.51, -19.42 -46.16, -47.04 APE12-dist-in 9.501 APE11-dist-in 11.237 APE10-dist-in 5.346 APE9-dist-in 3.607 None None None XRAY 2.0 0.189 0.225 A 291 276 12 0 0 0 [[165, 446]] 1.0 6bql CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BQPA 161 448 588.0 6T2:60501 Type1 Active DFGin 6.879 13.941 BLAminus -127.73, 165.94 70.2, 92.8 -98.65, 20.48 287.69, 73.18 -57.53, -31.21 in-in in 9.397 Saltbr-in 2.884 HRD-in -64.73, -48.51 76.52, -1.98 in-in-in SNCiii in-in ActLoopNT-in 2.758 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.24, 171.23 APE9-dihe-na 110.1, -156.68 APE8-dihe-in -100.02, 128.5 APE8-rot-in 305.22 APE67-dihe-in -65.8, -14.31 -55.35, -41.21 APE12-dist-in 9.588 APE11-dist-in 11.269 APE10-dist-in 5.453 APE9-dist-in 3.477 None None None XRAY 1.95 0.191 0.227 A 291 262 26 0 0 0 [[165, 446]] 1.0 6bqp CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BQQA 161 448 588.0 R78:60501 Type1 Active DFGin 6.587 15.248 BLAminus -117.25, 175.16 63.58, 81.13 -94.81, 22.39 287.89, 75.14 -58.43, -30.74 out-in out 10.004 Saltbr-in 3.072 HRD-in -71.13, -51.2 74.86, 1.34 in-in-in SNCiii in-in ActLoopNT-in 2.839 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -126.24, 165.59 APE9-dihe-na 119.03, -163.74 APE8-dihe-in -97.53, 123.98 APE8-rot-in 297.33 APE67-dihe-in -61.07, -18.54 -48.02, -46.96 APE12-dist-in 8.872 APE11-dist-in 11.374 APE10-dist-in 5.454 APE9-dist-in 3.49 None None None XRAY 1.8 0.192 0.228 A 291 269 19 0 0 0 [[165, 446]] 1.0 6bqq CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BRCB 161 448 588.0 E5J:60501 Type1 Active DFGin 6.904 15.236 BLAminus -120.14, 170.48 63.5, 80.74 -90.91, 25.53 289.59, 77.07 -67.34, -16.81 in-in in 9.907 Saltbr-in 3.435 HRD-in -62.55, -51.64 71.8, 6.23 in-in-in SNCiii in-in ActLoopNT-in 2.895 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.45, 165.15 APE9-dihe-na 106.61, -160.8 APE8-dihe-in -95.67, 116.32 APE8-rot-in 308.37 APE67-dihe-in -65.13, -23.74 -47.49, -37.58 APE12-dist-in 9.86 APE11-dist-in 11.501 APE10-dist-in 5.568 APE9-dist-in 3.817 None None None XRAY 2.2 0.216 0.265 B 291 260 28 0 0 0 [[165, 446]] 1.0 6brc CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
8TUCA 161 449 588.0 O7I:60501 Type1 Active DFGin 6.731 14.453 BLAminus -127.72, 179.53 58.67, 73.65 -84.61, 18.43 283.38, 76.82 -62.91, -24.57 in-in in 9.569 Saltbr-in 2.799 HRD-in -82.06, -44.61 70.49, -2.43 in-in-in SNCiii in-in ActLoopNT-in 2.91 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -107.56, 162.98 APE9-dihe-na 165.6, 166.4 APE8-dihe-in -75.27, 125.03 APE8-rot-in 300.68 APE67-dihe-in -70.03, -12.9 -55.33, -38.49 APE12-dist-in 13.1 APE11-dist-in 9.505 APE10-dist-in 5.799 APE9-dist-in 3.731 None None None XRAY 1.5 0.169 0.207 A 291 276 13 0 0 0 [[165, 446]] 1.0 8tuc CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
2ZV2A 160 448 588.0 609:60501 Type1 Active DFGin 6.818 14.541 BLAminus -122.89, 173.96 59.26, 77.13 -93.92, 23.43 290.42, 66.64 -61.43, -10.01 in-in in 9.337 Saltbr-in 2.615 HRD-in -66.49, -45.72 70.26, -4.68 in-in-in SNCiii in-in ActLoopNT-in 2.822 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.51, 169.38 APE9-dihe-na 107.27, -162.96 APE8-dihe-in -95.28, 121.73 APE8-rot-in 305.12 APE67-dihe-in -59.79, -17.29 -35.35, -59.29 APE12-dist-in 9.52 APE11-dist-in 11.346 APE10-dist-in 5.465 APE9-dist-in 3.687 None None None XRAY 2.4 0.203 0.252 A 298 256 33 0 0 0 [[165, 446]] 1.0 2zv2 CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5YV8A 160 448 588.0 91L:501 Type1 Active DFGin 6.725 14.523 BLAminus -122.93, 171.8 61.22, 78.31 -87.86, 25.84 290.89, 69.95 -61.07, -25.0 in-in in 9.359 Saltbr-in 2.745 HRD-in -74.0, -48.27 70.52, 3.16 in-in-in SNCiii in-in ActLoopNT-in 2.806 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -140.77, 167.4 APE9-dihe-na 111.03, -156.22 APE8-dihe-in -103.08, 122.32 APE8-rot-in 295.96 APE67-dihe-in -65.57, -15.92 -51.87, -44.0 APE12-dist-in 9.367 APE11-dist-in 11.202 APE10-dist-in 5.356 APE9-dist-in 3.597 None None CAS397 XRAY 1.927 0.166 0.213 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yv8 CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5YVAA 160 448 588.0 91X:501 Type1 Active DFGin 6.736 14.325 BLAminus -123.18, 167.02 68.45, 82.08 -95.99, 27.99 293.38, 80.7 -66.32, -18.53 in-in in 9.265 Saltbr-in 2.893 HRD-in -76.51, -45.12 68.31, 6.55 in-in-in SNCiii in-in ActLoopNT-in 2.825 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -143.47, 165.54 APE9-dihe-na 111.29, -156.09 APE8-dihe-in -98.36, 125.88 APE8-rot-in 309.21 APE67-dihe-in -49.38, -26.44 -46.56, -55.31 APE12-dist-in 9.434 APE11-dist-in 11.298 APE10-dist-in 5.512 APE9-dist-in 3.699 None None CAS397 XRAY 2.574 0.163 0.22 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yva CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5YVBA 160 448 588.0 92C:501 Type1 Active DFGin 6.829 14.446 BLAminus -125.28, 169.51 70.11, 86.05 -99.6, 30.35 290.81, 70.43 -69.33, -23.64 in-in in 9.568 Saltbr-in 3.185 HRD-in -71.8, -48.31 70.01, 2.3 in-in-in SNCiii in-in ActLoopNT-in 2.772 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.36, 168.27 APE9-dihe-na 114.71, -158.26 APE8-dihe-in -101.76, 124.26 APE8-rot-in 302.21 APE67-dihe-in -63.45, -17.31 -51.16, -44.24 APE12-dist-in 9.277 APE11-dist-in 11.194 APE10-dist-in 5.355 APE9-dist-in 3.713 None None CAS397 XRAY 2.02 0.172 0.215 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yvb CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5YVCA 160 448 588.0 SU6:501 Type1 Active DFGin 6.79 14.537 BLAminus -121.34, 170.34 67.45, 82.63 -94.98, 27.39 288.36, 72.02 -64.36, -27.04 in-in in 9.451 Saltbr-in 3.257 HRD-in -73.56, -49.13 72.24, 1.33 in-in-in SNCiii in-in ActLoopNT-in 2.688 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -142.0, 168.59 APE9-dihe-na 112.92, -160.28 APE8-dihe-in -100.86, 123.38 APE8-rot-in 301.38 APE67-dihe-in -63.99, -14.39 -47.95, -48.2 APE12-dist-in 9.445 APE11-dist-in 11.27 APE10-dist-in 5.445 APE9-dist-in 3.578 None None CAS397 XRAY 2.02 0.172 0.211 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yvc CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
5YV9A 160 448 588.0 91O:501 Type1.5_Back Active DFGin 6.73 14.452 BLAminus -123.85, 174.52 61.56, 81.87 -92.24, 22.41 290.07, 70.32 -56.09, -23.41 in-in in 9.661 Saltbr-in 3.221 HRD-in -74.56, -49.39 67.45, 5.32 in-in-in SNCiii in-in ActLoopNT-in 2.815 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.69, 168.21 APE9-dihe-na 108.77, -158.78 APE8-dihe-in -93.76, 126.06 APE8-rot-in 306.2 APE67-dihe-in -60.25, -10.01 -55.44, -47.7 APE12-dist-in 9.441 APE11-dist-in 11.217 APE10-dist-in 5.401 APE9-dist-in 3.592 None None CAS397 XRAY 2.53 0.17 0.222 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yv9 CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
6BRCA 161 448 588.0 E5J:60501 Type1 None DFGin 6.926 15.179 BLAminus -120.53, 171.08 63.24, 80.67 -89.54, 24.54 291.35, 76.67 -66.53, -18.07 in-none in 9.862 Saltbr-none 999.0 HRD-in -61.64, -52.23 71.81, 8.67 none-in-in SNCnii in-in ActLoopNT-in 2.886 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.08, 165.18 APE9-dihe-na 110.63, -166.81 APE8-dihe-in -91.91, 115.92 APE8-rot-in 307.72 APE67-dihe-in -63.99, -23.41 -49.22, -36.7 APE12-dist-in 9.729 APE11-dist-in 11.45 APE10-dist-in 5.523 APE9-dist-in 3.785 None None None XRAY 2.2 0.216 0.265 A 291 263 25 0 0 0 [[165, 446]] 1.0 6brc CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2

CAMK_CAMKK2 (Calcium/calmodulin-dependent protein kinase kinase 2)

Total number of chains: 21
Active chains: 20
Family: CAMK
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 21 100.0% AF-Q96RR4-K1A

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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
KKCC2_HUMAN AF-Q96RR4-K1A Q96RR4 157 454 588.0 No_ligand No_ligand Active DFGin 6.665 14.169 BLAminus -132.44, 175.99 57.36, 68.16 -76.57, 14.76 286.1, 81.79 -62.55, -23.22 in-in in 9.394 Saltbr-in 2.695 HRD-in -79.64, -48.25 68.82, -0.98 in-in-in SNCiii in-in ActLoopNT-in 2.951 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.01, 169.11 APE9-dihe-na 104.28, -176.67 APE8-dihe-in -78.12, 125.37 APE8-rot-in 303.5 APE67-dihe-in -69.04, -13.45 -51.83, -41.76 APE12-dist-in 10.041 APE11-dist-in 11.409 APE10-dist-in 5.575 APE9-dist-in 3.675 None None None AF2 -1.0 1.0 1.0 A 298 298 0 0 0 0 [[165, 446]] 1.0 AF-Q96RR4-K1 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN AF-Q96RR4-K3A Q96RR4 157 454 588.0 No_ligand No_ligand Active DFGin 6.467 14.428 BLAminus -128.41, 174.74 57.05, 81.6 -88.18, 14.62 288.81, 81.28 -63.4, -16.07 in-in in 9.319 Saltbr-in 2.712 HRD-in -77.71, -48.64 72.76, -3.48 in-in-in SNCiii in-in ActLoopNT-in 2.948 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.55, 162.31 APE9-dihe-na 106.94, -168.52 APE8-dihe-in -85.81, 124.48 APE8-rot-in 304.61 APE67-dihe-in -68.71, -15.46 -52.27, -41.23 APE12-dist-in 9.83 APE11-dist-in 11.286 APE10-dist-in 5.521 APE9-dist-in 3.906 None None None AF2 -1.0 1.0 1.0 A 298 298 0 0 0 0 [[165, 446]] 1.0 AF-Q96RR4-K3 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6CMJA Q96RR4 161 463 588.0 F6J:60501 Type1 Active DFGin 6.701 14.021 BLAminus -128.16, 173.53 66.84, 86.55 -100.45, 21.53 286.63, 76.45 -58.11, -34.47 in-in in 9.516 Saltbr-in 2.708 HRD-in -70.27, -50.6 73.87, 2.96 in-in-in SNCiii in-in ActLoopNT-in 2.948 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.24, 163.41 APE9-dihe-na 103.64, -157.45 APE8-dihe-in -90.88, 126.33 APE8-rot-in 303.07 APE67-dihe-in -67.03, -16.03 -51.77, -42.09 APE12-dist-in 9.98 APE11-dist-in 11.134 APE10-dist-in 5.259 APE9-dist-in 3.817 None SEP345,SEP400,TPO462 SEP345,SEP400,TPO462 XRAY 2.4 0.184 0.219 A 321 288 0 0 0 0 [[165, 446]] 1.0 6cmj Homo sapiens CAMK_CAMKK2_HUMAN CAMK 2.4e-75 259.1 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6CMJB Q96RR4 161 462 588.0 F6J:60501 Type1 Active DFGin 6.554 14.022 BLAminus -126.23, 173.65 67.8, 86.78 -100.71, 20.95 284.77, 76.92 -57.77, -33.94 in-in in 9.471 Saltbr-in 2.703 HRD-in -69.56, -50.79 72.39, 3.04 in-in-in SNCiii in-in ActLoopNT-in 2.937 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.14, 163.72 APE9-dihe-na 103.15, -157.71 APE8-dihe-in -91.26, 126.78 APE8-rot-in 302.39 APE67-dihe-in -66.21, -16.47 -51.31, -43.01 APE12-dist-in 9.849 APE11-dist-in 11.082 APE10-dist-in 5.224 APE9-dist-in 3.82 None SEP345,SEP400,TPO462 SEP345,SEP400,TPO462 XRAY 2.4 0.184 0.219 B 321 287 0 0 0 0 [[165, 446]] 1.0 6cmj Homo sapiens CAMK_CAMKK2_HUMAN CAMK 2.4e-75 259.1 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5UY6A Q96RR4 161 448 588.0 8R4:60501 Type1 Active DFGin 6.658 14.113 BLAminus -132.25, 178.64 58.27, 80.64 -92.28, 18.22 280.67, 75.88 -55.42, -33.9 in-in in 9.414 Saltbr-in 2.807 HRD-in -79.1, -48.26 75.47, 2.11 in-in-in SNCiii in-in ActLoopNT-in 2.949 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -105.81, 164.34 APE9-dihe-na 164.84, 175.43 APE8-dihe-in -85.88, 125.38 APE8-rot-in 293.83 APE67-dihe-in -66.95, -13.04 -45.29, -49.63 APE12-dist-in 12.905 APE11-dist-in 9.434 APE10-dist-in 5.805 APE9-dist-in 3.699 None None None XRAY 1.7 0.161 0.182 A 291 280 8 0 0 0 [[165, 446]] 1.0 5uy6 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5UYJA Q96RR4 161 449 588.0 8R7:60501 Type1 Active DFGin 6.677 14.259 BLAminus -132.08, 177.07 61.37, 75.95 -92.03, 18.28 280.27, 75.86 -52.8, -33.56 in-in in 9.609 Saltbr-in 2.819 HRD-in -81.51, -46.94 74.7, -2.01 in-in-in SNCiii in-in ActLoopNT-in 2.923 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -95.8, 177.18 APE9-dihe-na 146.73, 172.64 APE8-dihe-in -82.87, 120.29 APE8-rot-in 300.04 APE67-dihe-in -68.29, -15.78 -49.75, -38.95 APE12-dist-in 13.135 APE11-dist-in 9.542 APE10-dist-in 5.877 APE9-dist-in 3.8 None None None XRAY 1.6 0.154 0.171 A 291 279 10 0 0 0 [[165, 446]] 1.0 5uyj Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5VT1A Q96RR4 161 448 588.0 9JS:60501 Type1 Active DFGin 6.546 15.55 BLAminus -132.63, 175.89 60.91, 78.93 -96.17, 18.34 289.68, 79.81 -58.68, -37.7 in-in in 9.551 Saltbr-in 2.749 HRD-in -65.51, -51.56 73.13, -0.26 in-in-in SNCiii in-in ActLoopNT-in 2.771 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.36, 161.23 APE9-dihe-na 117.82, -160.36 APE8-dihe-in -95.25, 124.59 APE8-rot-in 296.31 APE67-dihe-in -61.09, -17.48 -48.27, -47.93 APE12-dist-in 9.741 APE11-dist-in 11.275 APE10-dist-in 5.375 APE9-dist-in 3.72 None None None XRAY 1.9 0.162 0.185 A 291 264 24 0 0 0 [[165, 446]] 1.0 5vt1 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BKUA Q96RR4 162 448 588.0 DXV:60501 Type1 Active DFGin 6.671 13.993 BLAminus -127.33, 174.32 63.79, 82.42 -93.37, 15.83 286.48, 75.23 -60.79, -22.1 in-in in 9.376 Saltbr-in 2.778 HRD-in -78.88, -49.79 72.64, 5.62 in-in-in SNCiii in-in ActLoopNT-in 2.87 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -109.85, 136.95 APE9-dihe-na -173.19, 179.59 APE8-dihe-in -86.46, 122.73 APE8-rot-in 300.93 APE67-dihe-in -60.17, -23.84 -48.28, -46.85 APE12-dist-in 12.68 APE11-dist-in 9.268 APE10-dist-in 5.511 APE9-dist-in 3.673 None None None XRAY 2.0 0.195 0.237 A 291 264 23 0 0 0 [[165, 446]] 1.0 6bku Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BLEA Q96RR4 161 448 588.0 34U:60501 Type1 Active DFGin 6.944 13.935 BLAminus -128.26, 170.03 71.11, 85.91 -96.22, 21.85 288.46, 75.34 -64.75, -26.18 in-in in 9.44 Saltbr-in 2.979 HRD-in -71.71, -49.79 72.3, -0.91 in-in-in SNCiii in-in ActLoopNT-in 2.791 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -134.97, 170.59 APE9-dihe-na 108.12, -153.2 APE8-dihe-in -104.48, 120.4 APE8-rot-in 301.26 APE67-dihe-in -69.03, -15.32 -42.71, -45.39 APE12-dist-in 9.752 APE11-dist-in 11.249 APE10-dist-in 5.436 APE9-dist-in 3.784 None None None XRAY 1.9 0.188 0.227 A 291 263 25 0 0 0 [[165, 446]] 1.0 6ble Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BQLA Q96RR4 161 448 588.0 BI9:60501 Type1 Active DFGin 6.775 15.905 BLAminus -125.08, 172.02 71.12, 81.11 -96.1, 13.43 287.91, 80.94 -58.33, -35.96 in-in in 9.654 Saltbr-in 3.536 HRD-in -69.05, -49.88 71.03, 0.77 in-in-in SNCiii in-in ActLoopNT-in 2.758 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -135.45, 168.13 APE9-dihe-na 102.75, -153.47 APE8-dihe-in -100.87, 121.4 APE8-rot-in 299.55 APE67-dihe-in -62.51, -19.42 -46.16, -47.04 APE12-dist-in 9.501 APE11-dist-in 11.237 APE10-dist-in 5.346 APE9-dist-in 3.607 None None None XRAY 2.0 0.189 0.225 A 291 276 12 0 0 0 [[165, 446]] 1.0 6bql Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BQPA Q96RR4 161 448 588.0 6T2:60501 Type1 Active DFGin 6.879 13.941 BLAminus -127.73, 165.94 70.2, 92.8 -98.65, 20.48 287.69, 73.18 -57.53, -31.21 in-in in 9.397 Saltbr-in 2.884 HRD-in -64.73, -48.51 76.52, -1.98 in-in-in SNCiii in-in ActLoopNT-in 2.758 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.24, 171.23 APE9-dihe-na 110.1, -156.68 APE8-dihe-in -100.02, 128.5 APE8-rot-in 305.22 APE67-dihe-in -65.8, -14.31 -55.35, -41.21 APE12-dist-in 9.588 APE11-dist-in 11.269 APE10-dist-in 5.453 APE9-dist-in 3.477 None None None XRAY 1.95 0.191 0.227 A 291 262 26 0 0 0 [[165, 446]] 1.0 6bqp Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BQQA Q96RR4 161 448 588.0 R78:60501 Type1 Active DFGin 6.587 15.248 BLAminus -117.25, 175.16 63.58, 81.13 -94.81, 22.39 287.89, 75.14 -58.43, -30.74 out-in out 10.004 Saltbr-in 3.072 HRD-in -71.13, -51.2 74.86, 1.34 in-in-in SNCiii in-in ActLoopNT-in 2.839 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -126.24, 165.59 APE9-dihe-na 119.03, -163.74 APE8-dihe-in -97.53, 123.98 APE8-rot-in 297.33 APE67-dihe-in -61.07, -18.54 -48.02, -46.96 APE12-dist-in 8.872 APE11-dist-in 11.374 APE10-dist-in 5.454 APE9-dist-in 3.49 None None None XRAY 1.8 0.192 0.228 A 291 269 19 0 0 0 [[165, 446]] 1.0 6bqq Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BRCB Q96RR4 161 448 588.0 E5J:60501 Type1 Active DFGin 6.904 15.236 BLAminus -120.14, 170.48 63.5, 80.74 -90.91, 25.53 289.59, 77.07 -67.34, -16.81 in-in in 9.907 Saltbr-in 3.435 HRD-in -62.55, -51.64 71.8, 6.23 in-in-in SNCiii in-in ActLoopNT-in 2.895 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.45, 165.15 APE9-dihe-na 106.61, -160.8 APE8-dihe-in -95.67, 116.32 APE8-rot-in 308.37 APE67-dihe-in -65.13, -23.74 -47.49, -37.58 APE12-dist-in 9.86 APE11-dist-in 11.501 APE10-dist-in 5.568 APE9-dist-in 3.817 None None None XRAY 2.2 0.216 0.265 B 291 260 28 0 0 0 [[165, 446]] 1.0 6brc Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 8TUCA Q96RR4 161 449 588.0 O7I:60501 Type1 Active DFGin 6.731 14.453 BLAminus -127.72, 179.53 58.67, 73.65 -84.61, 18.43 283.38, 76.82 -62.91, -24.57 in-in in 9.569 Saltbr-in 2.799 HRD-in -82.06, -44.61 70.49, -2.43 in-in-in SNCiii in-in ActLoopNT-in 2.91 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -107.56, 162.98 APE9-dihe-na 165.6, 166.4 APE8-dihe-in -75.27, 125.03 APE8-rot-in 300.68 APE67-dihe-in -70.03, -12.9 -55.33, -38.49 APE12-dist-in 13.1 APE11-dist-in 9.505 APE10-dist-in 5.799 APE9-dist-in 3.731 None None None XRAY 1.5 0.169 0.207 A 291 276 13 0 0 0 [[165, 446]] 1.0 8tuc Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 2ZV2A Q96RR4 160 448 588.0 609:60501 Type1 Active DFGin 6.818 14.541 BLAminus -122.89, 173.96 59.26, 77.13 -93.92, 23.43 290.42, 66.64 -61.43, -10.01 in-in in 9.337 Saltbr-in 2.615 HRD-in -66.49, -45.72 70.26, -4.68 in-in-in SNCiii in-in ActLoopNT-in 2.822 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.51, 169.38 APE9-dihe-na 107.27, -162.96 APE8-dihe-in -95.28, 121.73 APE8-rot-in 305.12 APE67-dihe-in -59.79, -17.29 -35.35, -59.29 APE12-dist-in 9.52 APE11-dist-in 11.346 APE10-dist-in 5.465 APE9-dist-in 3.687 None None None XRAY 2.4 0.203 0.252 A 298 256 33 0 0 0 [[165, 446]] 1.0 2zv2 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5YV8A Q96RR4 160 448 588.0 91L:501 Type1 Active DFGin 6.725 14.523 BLAminus -122.93, 171.8 61.22, 78.31 -87.86, 25.84 290.89, 69.95 -61.07, -25.0 in-in in 9.359 Saltbr-in 2.745 HRD-in -74.0, -48.27 70.52, 3.16 in-in-in SNCiii in-in ActLoopNT-in 2.806 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -140.77, 167.4 APE9-dihe-na 111.03, -156.22 APE8-dihe-in -103.08, 122.32 APE8-rot-in 295.96 APE67-dihe-in -65.57, -15.92 -51.87, -44.0 APE12-dist-in 9.367 APE11-dist-in 11.202 APE10-dist-in 5.356 APE9-dist-in 3.597 None None CAS397 XRAY 1.927 0.166 0.213 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yv8 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5YVAA Q96RR4 160 448 588.0 91X:501 Type1 Active DFGin 6.736 14.325 BLAminus -123.18, 167.02 68.45, 82.08 -95.99, 27.99 293.38, 80.7 -66.32, -18.53 in-in in 9.265 Saltbr-in 2.893 HRD-in -76.51, -45.12 68.31, 6.55 in-in-in SNCiii in-in ActLoopNT-in 2.825 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -143.47, 165.54 APE9-dihe-na 111.29, -156.09 APE8-dihe-in -98.36, 125.88 APE8-rot-in 309.21 APE67-dihe-in -49.38, -26.44 -46.56, -55.31 APE12-dist-in 9.434 APE11-dist-in 11.298 APE10-dist-in 5.512 APE9-dist-in 3.699 None None CAS397 XRAY 2.574 0.163 0.22 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yva Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5YVBA Q96RR4 160 448 588.0 92C:501 Type1 Active DFGin 6.829 14.446 BLAminus -125.28, 169.51 70.11, 86.05 -99.6, 30.35 290.81, 70.43 -69.33, -23.64 in-in in 9.568 Saltbr-in 3.185 HRD-in -71.8, -48.31 70.01, 2.3 in-in-in SNCiii in-in ActLoopNT-in 2.772 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -138.36, 168.27 APE9-dihe-na 114.71, -158.26 APE8-dihe-in -101.76, 124.26 APE8-rot-in 302.21 APE67-dihe-in -63.45, -17.31 -51.16, -44.24 APE12-dist-in 9.277 APE11-dist-in 11.194 APE10-dist-in 5.355 APE9-dist-in 3.713 None None CAS397 XRAY 2.02 0.172 0.215 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yvb Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5YVCA Q96RR4 160 448 588.0 SU6:501 Type1 Active DFGin 6.79 14.537 BLAminus -121.34, 170.34 67.45, 82.63 -94.98, 27.39 288.36, 72.02 -64.36, -27.04 in-in in 9.451 Saltbr-in 3.257 HRD-in -73.56, -49.13 72.24, 1.33 in-in-in SNCiii in-in ActLoopNT-in 2.688 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -142.0, 168.59 APE9-dihe-na 112.92, -160.28 APE8-dihe-in -100.86, 123.38 APE8-rot-in 301.38 APE67-dihe-in -63.99, -14.39 -47.95, -48.2 APE12-dist-in 9.445 APE11-dist-in 11.27 APE10-dist-in 5.445 APE9-dist-in 3.578 None None CAS397 XRAY 2.02 0.172 0.211 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yvc Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 5YV9A Q96RR4 160 448 588.0 91O:501 Type1.5_Back Active DFGin 6.73 14.452 BLAminus -123.85, 174.52 61.56, 81.87 -92.24, 22.41 290.07, 70.32 -56.09, -23.41 in-in in 9.661 Saltbr-in 3.221 HRD-in -74.56, -49.39 67.45, 5.32 in-in-in SNCiii in-in ActLoopNT-in 2.815 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.69, 168.21 APE9-dihe-na 108.77, -158.78 APE8-dihe-in -93.76, 126.06 APE8-rot-in 306.2 APE67-dihe-in -60.25, -10.01 -55.44, -47.7 APE12-dist-in 9.441 APE11-dist-in 11.217 APE10-dist-in 5.401 APE9-dist-in 3.592 None None CAS397 XRAY 2.53 0.17 0.222 A 298 260 29 0 0 0 [[165, 446]] 1.0 5yv9 Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.3e-73 253.5 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2
KKCC2_HUMAN 6BRCA Q96RR4 161 448 588.0 E5J:60501 Type1 None DFGin 6.926 15.179 BLAminus -120.53, 171.08 63.24, 80.67 -89.54, 24.54 291.35, 76.67 -66.53, -18.07 in-none in 9.862 Saltbr-none 999.0 HRD-in -61.64, -52.23 71.81, 8.67 none-in-in SNCnii in-in ActLoopNT-in 2.886 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -127.08, 165.18 APE9-dihe-na 110.63, -166.81 APE8-dihe-in -91.91, 115.92 APE8-rot-in 307.72 APE67-dihe-in -63.99, -23.41 -49.22, -36.7 APE12-dist-in 9.729 APE11-dist-in 11.45 APE10-dist-in 5.523 APE9-dist-in 3.785 None None None XRAY 2.2 0.216 0.265 A 291 263 25 0 0 0 [[165, 446]] 1.0 6brc Homo sapiens CAMK_CAMKK2_HUMAN CAMK 1.2e-73 253.6 1 256 256 329 330 331 333 335 194 236 240 309 311 310 312 372 357 352 351 350 349 348 347 346 268 Calcium/calmodulin-dependent protein kinase kinase 2

CAMK_CAMKK2 (Calcium/calmodulin-dependent protein kinase kinase 2)

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

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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