## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
167 |
47 |
19225 |
◊ |
A |
x,y,z |
1_555 |
168 |
46 |
19429 |
1555.6 |
-23.7 |
0.049 |
10 |
0 |
0 |
1.000 |
2 |
2 |
|
B |
65 |
23 |
19225 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
65 |
22 |
19429 |
595.9 |
-3.9 |
0.488 |
4 |
0 |
0 |
0.000 |
3 |
|
B |
63 |
22 |
19225 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
63 |
22 |
19429 |
595.3 |
-2.9 |
0.556 |
3 |
0 |
0 |
0.000 |
Average: |
595.6 |
-3.4 |
0.522 |
4 |
0 |
0 |
0.000 |
3 |
4 |
|
[12P]A:603 |
33 |
1 |
884 |
f |
A |
x,y,z |
1_555 |
63 |
21 |
19429 |
481.1 |
-1.6 |
0.401 |
7 |
0 |
0 |
0.363 |
5 |
|
[12P]B:603 |
34 |
1 |
885 |
f |
B |
x,y,z |
1_555 |
61 |
20 |
19225 |
480.1 |
-1.7 |
0.403 |
7 |
0 |
0 |
0.363 |
Average: |
480.6 |
-1.7 |
0.402 |
7 |
0 |
0 |
0.363 |
4 |
6 |
|
A |
31 |
9 |
19429 |
x |
A |
x,y,z-1 |
1_554 |
36 |
14 |
19429 |
279.4 |
1.2 |
0.749 |
3 |
2 |
0 |
0.000 |
7 |
|
B |
36 |
14 |
19225 |
x |
B |
x,y,z-1 |
1_554 |
30 |
8 |
19225 |
276.2 |
1.2 |
0.774 |
3 |
1 |
0 |
0.000 |
Average: |
277.8 |
1.2 |
0.762 |
3 |
2 |
0 |
0.000 |
5 |
8 |
|
A |
25 |
6 |
19429 |
x |
A |
x-1,y,z |
1_455 |
26 |
8 |
19429 |
242.5 |
-1.4 |
0.488 |
2 |
4 |
0 |
0.000 |
6 |
9 |
|
[12P]B:603 |
16 |
1 |
885 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
16 |
6 |
19429 |
146.3 |
2.2 |
0.558 |
2 |
0 |
0 |
0.000 |
10 |
|
B |
16 |
6 |
19225 |
◊ |
[12P]A:603 |
-x,y-1/2,-z+1 |
2_546 |
16 |
1 |
884 |
141.0 |
2.0 |
0.553 |
2 |
0 |
0 |
0.000 |
Average: |
143.7 |
2.1 |
0.556 |
2 |
0 |
0 |
0.000 |
7 |
11 |
|
A |
13 |
6 |
19429 |
◊ |
B |
x,y,z-1 |
1_554 |
12 |
6 |
19225 |
120.3 |
1.6 |
0.789 |
1 |
3 |
0 |
0.000 |
8 |
12 |
|
[DMS]B:607 |
4 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
19225 |
119.9 |
3.4 |
0.571 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
[DMS]A:607 |
4 |
1 |
208 |
◊ |
A |
x,y,z |
1_555 |
25 |
8 |
19429 |
116.7 |
2.7 |
0.558 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
[DMS]A:605 |
4 |
1 |
209 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
19429 |
112.4 |
2.7 |
0.561 |
0 |
0 |
0 |
0.000 |
15 |
|
[DMS]B:605 |
4 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
23 |
7 |
19225 |
111.9 |
2.8 |
0.565 |
1 |
0 |
0 |
0.000 |
Average: |
112.1 |
2.7 |
0.563 |
1 |
0 |
0 |
0.000 |
11 |
16 |
|
[DMS]B:606 |
4 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
19225 |
90.3 |
0.7 |
0.338 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
[DMS]A:606 |
4 |
1 |
208 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
19429 |
86.2 |
0.3 |
0.333 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[EDO]A:608 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
19429 |
78.5 |
1.9 |
0.251 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
[EDO]B:608 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
19225 |
76.2 |
1.6 |
0.254 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[EDO]B:608 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
19429 |
49.3 |
-0.1 |
0.190 |
1 |
0 |
0 |
0.022 |
16 |
21 |
|
[EDO]A:608 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
19225 |
46.8 |
0.2 |
0.226 |
0 |
0 |
0 |
0.000 |
17 |
22 |
|
[DMS]B:606 |
1 |
1 |
209 |
◊ |
[12P]B:603 |
x,y,z |
1_555 |
3 |
1 |
885 |
38.1 |
2.5 |
0.635 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
B |
4 |
1 |
19225 |
◊ |
[DMS]A:606 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
208 |
35.2 |
1.5 |
0.631 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[DMS]A:606 |
3 |
1 |
208 |
f |
[12P]A:603 |
x,y,z |
1_555 |
3 |
1 |
884 |
30.4 |
1.2 |
0.395 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[MN]A:602 |
1 |
1 |
123 |
f |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
28.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.108 |
21 |
26 |
|
[DMS]B:607 |
3 |
1 |
209 |
f |
[DMS]B:605 |
x,y,z |
1_555 |
2 |
1 |
209 |
28.3 |
1.3 |
0.390 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[MN]B:602 |
1 |
1 |
123 |
f |
[MN]B:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
28.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.108 |
23 |
28 |
|
[DMS]A:605 |
1 |
1 |
209 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
19225 |
28.1 |
0.3 |
0.303 |
0 |
0 |
0 |
0.000 |
29 |
|
[DMS]B:605 |
1 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
19429 |
27.7 |
0.3 |
0.307 |
0 |
0 |
0 |
0.000 |
Average: |
27.9 |
0.3 |
0.305 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[DMS]A:607 |
2 |
1 |
208 |
f |
[DMS]A:605 |
x,y,z |
1_555 |
2 |
1 |
209 |
26.3 |
1.6 |
0.750 |
0 |
0 |
0 |
0.000 |
25 |
31 |
|
[DMS]B:606 |
1 |
1 |
209 |
f |
A |
-x,y-1/2,-z |
2_545 |
4 |
1 |
19429 |
24.8 |
0.5 |
0.609 |
0 |
0 |
0 |
0.000 |
26 |
32 |
|
[DMS]A:607 |
1 |
1 |
208 |
f |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
19.3 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.016 |
27 |
33 |
|
[DMS]B:607 |
3 |
1 |
209 |
f |
[MN]B:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
13.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.012 |
28 |
34 |
|
[DMS]B:605 |
1 |
1 |
209 |
f |
[MN]B:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
5.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.012 |
35 |
|
[DMS]A:605 |
1 |
1 |
209 |
f |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
5.4 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
5.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.012 |
29 |
36 |
|
[DMS]B:605 |
1 |
1 |
209 |
f |
[MN]B:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
4.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.009 |
37 |
|
[DMS]A:605 |
2 |
1 |
209 |
f |
[MN]A:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
4.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
4.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.009 |
30 |
38 |
|
[DMS]B:607 |
1 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
19429 |
0.7 |
-0.0 |
0.368 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
[DMS]A:607 |
1 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
19225 |
0.3 |
0.0 |
0.380 |
0 |
0 |
0 |
0.000 |
|