Table 2.
CRF1R bound to agonist CRF | |||||
---|---|---|---|---|---|
No | CRF-CRF1R residue pair | Region of CRF |
Region of CRF1R | Cβ-Cβ distance [Å] | |
Constraint | Measured | ||||
1 | H13-F330 | N-term | Helix VI | 10.0 | 5.1 |
2 | H13-F344 | N-term | Helix VII | 10.0 | 9.4 |
3 | L15-Q173 | N-term | Helix II | 10.0 | 7.1 |
4 | E17-I345 | N-term | Helix VII | 10.0 | 9.2 |
5 | V18-V120 | C-term | Helix I | 10.0 | 6.4 |
6 | A31-E104 | C-term | Hinge | 10.0 | 8.6 |
7 | S33-Y73 | C-term | ECD | 10.0 | 6.7 |
CRF1R bound to Antagonist dFXCRF(12-41) | |||||
No | CRF1R-dFXCRF(12-41) residue pair | Region of dFXCRF(12-41) | Region of CRF1R | Cβ-Cβ or N-Cβ* distance [Å] | |
Constraint | Measured | ||||
1 | F12-L329 | N-term | Helix VI | 5.0* | 4.4* |
2 | F12-F330 | N-term | Helix VI | 5.0* | 4.6* |
3 | F12-N348 | N-term | Helix VII | 5.0* | 4.8* |
4 | H13-L329 | N-term | Helix VI | 10.0 | 6.7 |
5 | H13-F330 | N-term | Helix VI | 10.0 | 5.5 |
6 | H13-F344 | N-term | Helix | 10.0 | 5.0 |
7 | L14-N123 | N-term | Helix I | 10.0 | 9.1 |
8 | L15-R341 | N-term | Helix VII | 10.0 | 5.9 |
9 | L15-I345 | N-term | Helix VII | 10.0 | 6.8 |
10 | E17-N123 | N-term | Helix I | 10.0 | 7.4 |
11 | E17-Q173 | N-term | Helix II | 10.0 | 6.3 |
12 | E17-I345 | N-term | Helix VII | 10.0 | 6.1 |
13 | V18-V120 | C-term | Helix I | 10.0 | 4.7 |
14 | A31-E104 | C-term | Hinge | 10.0 | 4.3 |
15 | S33-Y73 | C-term | ECD | 10.0 | 6.7 |
*Pair-wise crosslinking between N-terminal ClAc in the peptide and Cys thiol in CRF1R.