From: Molecular models of human P-glycoprotein in two different catalytic states
Residues | Region | Cα-Cα distances (Å) | Exp. cross-linking (Å) | Ref. | |||
---|---|---|---|---|---|---|---|
 |  | Nucl.-bound* | Nucl.-bound** | Closed-nucl.-free | Open-nucl.-free |  |  |
NBDs | |||||||
S1072/L531 | WalkerA/Signature | 9.9 | 10.5 | 41.0 | 65.6 | 5.5–15 | [47] |
S1072/S532 | Â | 6.8 | 7.5 | 37.7 | 63.2 | Â | Â |
G1073/L531 | Â | 7.6 | 8.3 | 37.2 | 68.1 | Â | Â |
G1073/S532 | Â | 5.4 | 6.3 | 33.9 | 65.8 | Â | Â |
G1073/G533 | Â | 7.9 | 8.9 | 30.5 | 65.2 | Â | Â |
C1074/L531 | Â | 10.8 | 10.8 | 34.9 | 65.4 | Â | Â |
G1075/L531 | Â | 10.4 | 10.6 | 37.5 | 66.7 | Â | Â |
S429/L1176 | Â | 10.0 | 10.6 | 40.1 | 66.5 | Â | Â |
G430/L1176 | Â | 7.6 | 8.4 | 36.3 | 68.7 | Â | Â |
G431/L1176 | Â | 10.9 | 10.9 | 34.1 | 66.6 | Â | Â |
G432/L1176 | Â | 10.5 | 10.7 | 36.9 | 68.1 | Â | Â |
C431/L1176 | Â | 10.9 | 10.9 | 34.1 | 66.6 | Â | [48] |
L531/C1074 | Â | 10.8 | 10.8 | 34.9 | 65.4 | Â | Â |
G427/C1074 | WalkerA/WalkerA | 31.0 | 30.9 | 13.5 | 56.8 | Â | [63] |
L439/C1074 | Â | 36.6 | 35.7 | 19.4 | 64.6 | Â | Â |
C431/C1074 | Â | 33.4 | 33.1 | 7.9 | 54.0 | Â | [64] |
NBD:TMD | |||||||
L443/S909 |  | 8.6 | 9.8 | 14.2 | 9.2 | 6–16 | [44] |
S474/R905 | Â | 8.9 | 9.0 | 8.4 | 11.4 | Â | Â |
A266/F1086 |  | 8.6 | 10.0 | 13.8 | 9.7 | 5.5–15 | [45] |
Y490/V907 (CFTR: F508/L1065) | Â | 7.9 | 9.1 | 12.5 | 9.2 | Â | [46] |
Y490/L910 (CFTR: F508/F1068) | Â | 7.2 | 6.9 | 8.7 | 8.0 | Â | Â |
Y490/T911 (CFTR: F508/G1069) | Â | 9.5 | 8.2 | 11.5 | 9.5 | Â | Â |
Y490/F916 (CFTR: F508/F1074) | Â | 9.3 | 10.2 | 10.6 | 10.3 | Â | Â |
E493/T911 (CFTR: V510/G1069) | Â | 10.6 | 8.6 | 8.3 | 10.0 | Â | Â |
V478/T906 (CFTR: W496/T1064) | Â | 6.5 | 7.4 | 8.2 | 9.6 | Â | Â |
F480/V907 (CFTR: M498/L1065) | Â | 10.8 | 10.8 | 11.7 | 11.7 | Â | Â |
R547/T911 (CFTR: K564/G1069) | Â | 11.0 | 9.9 | 15.4 | 13.0 | Â | Â |
G269/Q1107 (CFTR: C276/Q1280) | Â | 8.4 | 10.4 | 13.5 | 11.8 | Â | Â |
G269/A1111 (CFTR: C276/K1284) | Â | 8.5 | 10.1 | 13.4 | 11.2 | Â | Â |
TMDs | |||||||
A80/T74 (MsbA: F56/F56) | TM2/TM8 | 33.0 | 34.5 | 22.8 | 12.9 | Â | [68] |
M68/Y950 | TM1/TM11 | 9.5 | 11.8 | 15.7 | 10.8 | Â | [94] |
M68/Y953 | Â | 7.8 | 13.0 | 16.9 | 11.7 | Â | Â |
M68/A954 | Â | 8.1 | 12.8 | 17.9 | 13.5 | Â | Â |
M69/A954 | Â | 10.9 | 15.2 | 20.8 | 16.1 | Â | Â |
M69/F957 | Â | 10.3 | 15.4 | 20.5 | 15.4 | Â | Â |
V133/G939 | TM2/TM11 | 5.6 | 5.7 | 12.0 | 7.0 | Â | [95] |
C137/A935 | Â | 6.7 | 6.9 | 10.5 | 7.6 | Â | Â |
117YYS119/555GCF557# |  | 9.1–15.7 | 9.6–15.6 | 16.5–22.0 | 9.7–15.5 | 6–16 | [25] |
S222/I868 | TM4/TM10 | 41.4 | 46.1 | 42.1 | 34.3 | 9–25 | [96] |
S222/G872 | Â | 41.7 | 45.0 | 41.5 | 34.3 | Â | Â |
L227/S993 | TM4/TM12 | 32.8 | 34.9 | 37.8 | 31.4 | 5.5–15 | [97] |
V231/S993 | Â | 32.4 | 33.1 | 34.2 | 30.3 | Â | Â |
W232/S993 | Â | 29.4 | 29.9 | 30.7 | 28.5 | Â | Â |
A233/S993 | Â | 28.1 | 28.6 | 29.6 | 25.4 | Â | Â |
I235/S993 | Â | 30.9 | 30.9 | 30.6 | 29.7 | Â | Â |
L236/S993 | Â | 27.3 | 27.4 | 27.2 | 26.6 | Â | Â |
N296/G774 | TM5/TM8 | 5.6 | 5.8 | 11.9 | 7.1 | Â | [98] |
I299/F770 | Â | 7.7 | 7.9 | 11.5 | 9.5 | Â | Â |
I299/G774 | Â | 8.8 | 10.3 | 16.7 | 11.9 | Â | Â |
G300/F770 | Â | 5.6 | 6.9 | 12.8 | 7.7 | Â | Â |
317GTT319/753NLF755# |  | 9.8–15.2 | 9.2–14.0 | 19.0–23.8 | 9.4–14.6 | 6–16 | [25] |
I306/I868 | TM5/TM10 | 36.3 | 41.0 | 34.6 | 32.1 | 13–25 | [96] |
I306/G872 | Â | 36.7 | 40.4 | 34.9 | 33.4 | Â | Â |
I306/T945 | TM5/TM11 | 33.5 | 37.0 | 30.0 | 33.2 | Â | Â |
I306/V982 | TM5/TM12 | 24.4 | 31.3 | 24.4 | 19.0 | Â | Â |
I306/G984 | Â | 27.8 | 31.1 | 26.1 | 21.5 | Â | Â |
A295/S993 |  | 23.2 | 24.1 | 24.2 | 22.3 | 5.5–15 | [97] |
I299/S993 | Â | 22.6 | 24.5 | 26.3 | 21.2 | Â | Â |
L339/F728 | TM6/TM7 | 6.7 | 10.7 | 18.1 | 19.2 | 20–25 | [99] |
P350/V874 | TM6/TM10 | 32.5 | 33.2 | 34.5 | 29.9 | 5.5–15 | [97] |
P350/E350 | Â | 29.4 | 30.1 | 31.0 | 27.9 | Â | Â |
P350/M876 | Â | 28.2 | 28.6 | 29.7 | 24.8 | Â | Â |
L339/I868 |  | 30.0 | 37.1 | 30.4 | 23.3 | 13–25 | [96] |
L339/G872 | Â | 32.0 | 37.7 | 29.9 | 23.7 | Â | Â |
L332/Q856 |  | 36.0 | 41.3 | 33.5 | 21.4 | 10–17 |  |
P350/G939 | TM6/TM11 | 22.9 | 23.6 | 25.3 | 19.2 | 5.5–15 | [97] |
L339/T945 |  | 27.5 | 33.1 | 24.5 | 21.5 | 20–25 | [100] |
L339/F942 | Â | 26.7 | 31.2 | 22.1 | 21.0 | 25 | [96] |
L332/L975 | TM6/TM12 | 21.9 | 27.3 | 17.6 | 7.8 | 5.5–15 | [99] |
F343/M986 | Â | 16.4 | 20.0 | 18.6 | 21.6 | Â | [101] |
G346/G989 | Â | 20.2 | 23.7 | 23.5 | 26.4 | Â | Â |
P350/S993 | Â | 17.3 | 19.5 | 25.4 | 32.1 | Â | Â |
F343/V982 | Â | 16.8 | 23.3 | 20.5 | 18.9 | 10 | [99] |
L339/V982 |  | 15.6 | 25.1 | 20.7 | 15.1 | 16–25 |  |
L339/A985 |  | 19.6 | 26.9 | 23.2 | 19.1 | 20–25 | [96] |
L332/L976 |  | 22.0 | 28.2 | 17.8 | 11.2 | 9–13 |  |