Ggust - CT receptor complex model

GPCR CLASS (FAMILY)

B1 (Secretin)

SPECIES

Homo sapiens

G PROTEIN FAMILY

Gi/o

DATE

2023-09-15

3D VIEW

NGL is a WebGL based 3D viewer powered by MMTF.


Tertiary structure confidence

(pLDDT score) avg.: 80.5

Very high (>90)
Confident (90-70)
Low (70-50)
Very low (<50)
Disordered

PTM Score: 0.6
iPTM Score: 0.6
PAE mean: 15.8


GPCR - G protein interface interactions



The biflare plot is a modified version of a flareplot, where lines are drawn between an inner concentric circle (Gα residues) and an outer concentric circle (GPCR residues) depicting the interface interactions.
Different interaction types are shown with different line types (aromatic - solid, hydrophobic - dashed, ionic - long dashed, polar - dotted, Van der Waals - dash-dot).
The interactive features include filtering on interaction type, segments, residues and backbone or sidechain interactions.


Interaction cut-off:

Residue numbering:

GPCR-G protein backbone (bb) or sidechain (sc):





Structures

Sequence Color

Gα, GPCR
Interaction cut-off: strict (stick), loose (line)

NGL is a WebGL based 3D viewer powered by MMTF.

Interaction
type		 GPCR
Segment
AA
Number		 Generic
number		 Gα
segment
AA
Number		 Generic
number
Polar C-term Y 441 - G.H3 S 252 G.H3.11
Hydrophobic C-term I 463 - G.S2 I 184 G.S2.01
Hydrophobic ICL2 V 252 - G.H5 I 344 G.H5.16
Ionic TM2 R 180 2x46 G.H5 D 350 G.H5.22
Polar TM2 R 180 2x46 G.H5 D 350 G.H5.22
Hydrophobic TM2 R 180 2x46 G.H5 D 350 G.H5.22
Van-der-waals TM2 R 180 2x46 G.H5 D 350 G.H5.22
Polar ICL2 K 256 - G.HN Q 24 G.HN.48
Van-der-waals ICL2 K 256 - G.HN Q 24 G.HN.48
Ionic C-term E 461 - G.H2 K 210 G.H2.06
Hydrophobic C-term L 465 - G.S2 E 186 G.S2.03
Hydrophobic TM3 L 244 3x54 G.H5 L 353 G.H5.25
Hydrophobic C-term I 438 - G.H3 Y 258 G.H3.17
Van-der-waals C-term I 438 - G.H3 Y 258 G.H3.17
Hydrophobic ICL2 V 252 - G.H5 I 343 G.H5.15
Van-der-waals ICL2 V 252 - G.H5 I 343 G.H5.15
Hydrophobic TM5 L 323 5x61 G.H5 L 348 G.H5.20
Hydrophobic ICL2 F 253 - G.H5 I 343 G.H5.15
Hydrophobic C-term L 465 - G.S3 F 199 G.S3.06
Hydrophobic TM5 T 330 5x68 G.h4s6 E 318 G.h4s6.12
Van-der-waals TM5 T 330 5x68 G.h4s6 E 318 G.h4s6.12
Hydrophobic TM3 I 248 3x58 G.H5 L 353 G.H5.25
Hydrophobic ICL2 F 253 - G.S3 L 194 G.S3.01
Van-der-waals ICL2 F 253 - G.S3 L 194 G.S3.01
Polar C-term C 443 - G.H2 R 205 G.H2.01
Van-der-waals C-term C 443 - G.H2 R 205 G.H2.01
Polar C-term N 466 - G.S2 E 186 G.S2.03
Van-der-waals C-term N 466 - G.S2 E 186 G.S2.03
Ionic ICL2 E 255 - G.hns1 R 32 G.hns1.03
Polar ICL2 E 255 - G.hns1 R 32 G.hns1.03
Hydrophobic ICL2 E 255 - G.hns1 R 32 G.hns1.03
Van-der-waals ICL2 E 255 - G.hns1 R 32 G.hns1.03
Polar C-term I 468 - G.S2 E 186 G.S2.03
Van-der-waals C-term I 468 - G.S2 E 186 G.S2.03
Ionic ICL2 K 256 - G.HN E 28 G.HN.52
Polar ICL2 K 256 - G.HN E 28 G.HN.52
Hydrophobic ICL2 K 256 - G.HN E 28 G.HN.52
Van-der-waals ICL2 K 256 - G.HN E 28 G.HN.52
Polar TM3 L 247 3x57 G.H5 N 347 G.H5.19
Hydrophobic TM3 L 247 3x57 G.H5 N 347 G.H5.19
Hydrophobic TM3 L 244 3x54 G.H5 C 351 G.H5.23
Van-der-waals TM3 L 244 3x54 G.H5 C 351 G.H5.23
Hydrophobic C-term I 442 - G.H2 W 211 G.H2.07
Polar C-term N 466 - G.S2 I 184 G.S2.01
Van-der-waals C-term N 466 - G.S2 I 184 G.S2.01
Hydrophobic C-term I 468 - G.S2 I 185 G.S2.02
Van-der-waals C-term I 468 - G.S2 I 185 G.S2.02
Hydrophobic TM5 K 326 5x64 G.H5 I 344 G.H5.16
Hydrophobic C-term I 440 - G.H2 I 212 G.H2.08
Van-der-waals C-term I 440 - G.H2 I 212 G.H2.08
Hydrophobic TM6 A 344 6x41 G.H5 L 353 G.H5.25
Van-der-waals TM6 A 344 6x41 G.H5 L 353 G.H5.25
Polar C-term I 442 - G.H2 R 208 G.H2.04
Hydrophobic C-term I 442 - G.H2 R 208 G.H2.04
Hydrophobic C-term I 438 - G.H3 K 257 G.H3.16
Van-der-waals C-term I 438 - G.H3 K 257 G.H3.16
Hydrophobic TM5 L 323 5x61 G.H5 L 353 G.H5.25
Polar C-term I 442 - G.H3 S 252 G.H3.11
Hydrophobic C-term I 442 - G.H3 S 252 G.H3.11
Van-der-waals C-term I 442 - G.H3 S 252 G.H3.11
Hydrophobic TM2 R 180 2x46 G.H5 C 351 G.H5.23
Hydrophobic ICL2 V 252 - G.H5 T 340 G.H5.12
Polar C-term Q 470 - H.HA E 65 H.HA.03
Polar C-term H 444 - G.H3 H 248 G.H3.07
Aromatic C-term H 444 - G.H3 H 248 G.H3.07
Hydrophobic C-term H 444 - G.H3 H 248 G.H3.07
Van-der-waals C-term H 444 - G.H3 H 248 G.H3.07
Hydrophobic C-term I 463 - G.hfs2 G 183 G.hfs2.07
Hydrophobic TM3 I 248 3x58 G.H5 I 344 G.H5.16
Ionic TM5 K 326 5x64 G.H5 D 341 G.H5.13
Polar TM5 K 326 5x64 G.H5 D 341 G.H5.13
Hydrophobic TM5 K 326 5x64 G.H5 D 341 G.H5.13
Van-der-waals TM5 K 326 5x64 G.H5 D 341 G.H5.13
Hydrophobic TM5 T 330 5x68 G.H5 K 345 G.H5.17
Van-der-waals TM5 T 330 5x68 G.H5 K 345 G.H5.17
Polar C-term I 468 - G.h1ha K 58 G.h1ha.01
Hydrophobic C-term C 443 - G.H2 R 208 G.H2.04
Hydrophobic C-term I 442 - G.h2s4 F 215 G.h2s4.01
Hydrophobic C-term I 467 - G.S2 E 186 G.S2.03
Hydrophobic TM5 M 327 5x65 G.H5 F 354 G.H5.26
Hydrophobic C-term L 465 - G.S2 I 184 G.S2.01
Hydrophobic C-term C 443 - G.H2 K 209 G.H2.05
Aromatic ICL2 F 253 - G.H5 F 336 G.H5.08
Hydrophobic ICL2 F 253 - G.H5 F 336 G.H5.08
Van-der-waals ICL2 F 253 - G.H5 F 336 G.H5.08
Hydrophobic C-term I 442 - G.H3 L 249 G.H3.08
Van-der-waals C-term I 442 - G.H3 L 249 G.H3.08
Hydrophobic C-term I 463 - G.H2 K 210 G.H2.06
Van-der-waals C-term I 463 - G.H2 K 210 G.H2.06
Hydrophobic TM6 L 348 6x45 G.H5 L 353 G.H5.25
Van-der-waals TM6 L 348 6x45 G.H5 L 353 G.H5.25
Hydrophobic TM3 I 248 3x58 G.H5 L 348 G.H5.20
Van-der-waals TM3 I 248 3x58 G.H5 L 348 G.H5.20
Hydrophobic TM6 I 347 6x44 G.H5 L 353 G.H5.25
Van-der-waals TM6 I 347 6x44 G.H5 L 353 G.H5.25
Polar C-term S 473 - G.h1ha N 59 G.h1ha.02
Polar C-term E 469 - G.S2 Q 188 G.S2.05
Hydrophobic C-term E 469 - G.S2 Q 188 G.S2.05
Ionic ICL1 R 174 12x48 G.HN E 20 G.HN.44
Polar ICL1 R 174 12x48 G.HN E 20 G.HN.44
Van-der-waals ICL1 R 174 12x48 G.HN E 20 G.HN.44
Hydrophobic C-term I 463 - G.H2 H 213 G.H2.09
Van-der-waals C-term I 463 - G.H2 H 213 G.H2.09
Hydrophobic ICL2 F 253 - G.H5 T 340 G.H5.12
Van-der-waals ICL2 F 253 - G.H5 T 340 G.H5.12
Hydrophobic C-term I 438 - G.H3 H 256 G.H3.15
Hydrophobic TM6 I 347 6x44 G.H5 G 352 G.H5.24
Van-der-waals TM6 I 347 6x44 G.H5 G 352 G.H5.24