## |
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 |
|
E |
131 |
32 |
11544 |
◊ |
B |
x,y,z |
1_555 |
135 |
33 |
12579 |
1256.8 |
-7.6 |
0.754 |
9 |
11 |
0 |
0.973 |
2 |
|
F |
132 |
32 |
11516 |
◊ |
C |
x,y,z |
1_555 |
133 |
33 |
12669 |
1226.7 |
-5.8 |
0.867 |
12 |
9 |
0 |
0.973 |
3 |
|
D |
131 |
32 |
11610 |
◊ |
A |
x,y,z |
1_555 |
130 |
33 |
12762 |
1213.8 |
-7.5 |
0.778 |
12 |
9 |
0 |
0.973 |
Average: |
1232.4 |
-7.0 |
0.799 |
11 |
10 |
0 |
0.973 |
2 |
4 |
|
D |
83 |
21 |
11610 |
◊ |
B |
x,y,z |
1_555 |
89 |
21 |
12579 |
846.8 |
-16.3 |
0.111 |
3 |
0 |
0 |
0.601 |
5 |
|
E |
78 |
21 |
11544 |
◊ |
A |
x,y,z |
1_555 |
83 |
20 |
12762 |
806.5 |
-20.0 |
0.021 |
1 |
0 |
0 |
0.601 |
6 |
|
F |
78 |
19 |
11516 |
◊ |
C |
-x+1,y,-z+3 |
2_658 |
83 |
21 |
12669 |
806.0 |
-15.3 |
0.132 |
2 |
0 |
0 |
0.601 |
Average: |
819.8 |
-17.2 |
0.088 |
2 |
0 |
0 |
0.601 |
3 |
7 |
|
I |
35 |
9 |
1455 |
◊ |
C |
x,y,z |
1_555 |
57 |
13 |
12669 |
493.7 |
-11.8 |
0.275 |
2 |
1 |
0 |
0.400 |
8 |
|
G |
41 |
10 |
1381 |
◊ |
A |
x,y,z |
1_555 |
59 |
13 |
12762 |
474.9 |
-10.8 |
0.310 |
1 |
0 |
0 |
0.400 |
Average: |
484.3 |
-11.3 |
0.293 |
2 |
1 |
0 |
0.400 |
4 |
9 |
|
H |
35 |
8 |
1347 |
◊ |
B |
x,y,z |
1_555 |
51 |
14 |
12579 |
470.1 |
-11.3 |
0.198 |
1 |
1 |
0 |
0.386 |
5 |
10 |
|
[OHT]C:502 |
27 |
1 |
639 |
◊ |
C |
x,y,z |
1_555 |
63 |
24 |
12669 |
447.8 |
1.3 |
0.505 |
4 |
0 |
0 |
0.010 |
11 |
|
[OHT]D:503 |
27 |
1 |
639 |
◊ |
D |
x,y,z |
1_555 |
60 |
24 |
11610 |
446.6 |
1.7 |
0.440 |
3 |
0 |
0 |
0.010 |
12 |
|
[OHT]B:501 |
27 |
1 |
639 |
◊ |
B |
x,y,z |
1_555 |
57 |
24 |
12579 |
445.2 |
1.5 |
0.456 |
3 |
0 |
0 |
0.010 |
13 |
|
[OHT]E:504 |
27 |
1 |
629 |
◊ |
E |
x,y,z |
1_555 |
57 |
23 |
11544 |
443.3 |
1.3 |
0.392 |
3 |
0 |
0 |
0.010 |
14 |
|
[OHT]A:500 |
27 |
1 |
637 |
◊ |
A |
x,y,z |
1_555 |
61 |
24 |
12762 |
442.0 |
1.3 |
0.473 |
3 |
0 |
0 |
0.010 |
15 |
|
[OHT]F:505 |
26 |
1 |
635 |
◊ |
F |
x,y,z |
1_555 |
64 |
23 |
11516 |
440.9 |
1.5 |
0.459 |
3 |
0 |
0 |
0.010 |
Average: |
444.3 |
1.4 |
0.454 |
3 |
0 |
0 |
0.010 |
6 |
16 |
|
D |
32 |
8 |
11610 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
35 |
11 |
12762 |
293.9 |
-3.3 |
0.487 |
2 |
3 |
0 |
0.000 |
7 |
17 |
|
D |
26 |
6 |
11610 |
◊ |
B |
x,y,z-1 |
1_554 |
31 |
10 |
12579 |
293.8 |
-3.7 |
0.343 |
2 |
4 |
0 |
0.249 |
18 |
|
A |
29 |
9 |
12762 |
◊ |
E |
x,y,z-1 |
1_554 |
24 |
6 |
11544 |
274.6 |
-4.1 |
0.255 |
2 |
3 |
0 |
0.249 |
19 |
|
F |
21 |
5 |
11516 |
◊ |
C |
-x+1,y,-z+2 |
2_657 |
29 |
8 |
12669 |
253.4 |
-4.6 |
0.224 |
2 |
4 |
0 |
0.249 |
Average: |
274.0 |
-4.1 |
0.274 |
2 |
4 |
0 |
0.249 |
8 |
20 |
|
A |
25 |
7 |
12762 |
◊ |
F |
x-1/2,y+1/2,z-1 |
3_454 |
33 |
7 |
11516 |
282.2 |
-6.5 |
0.119 |
1 |
0 |
0 |
0.155 |
21 |
|
C |
26 |
7 |
12669 |
◊ |
E |
-x+1/2,y-1/2,-z+2 |
4_547 |
33 |
7 |
11544 |
273.3 |
-6.2 |
0.168 |
2 |
0 |
0 |
0.155 |
Average: |
277.8 |
-6.3 |
0.143 |
2 |
0 |
0 |
0.155 |
9 |
22 |
|
I |
20 |
4 |
1455 |
◊ |
E |
-x+1/2,y-1/2,-z+2 |
4_547 |
30 |
10 |
11544 |
237.6 |
-3.4 |
0.444 |
3 |
2 |
0 |
0.110 |
23 |
|
G |
21 |
5 |
1381 |
◊ |
F |
x-1/2,y+1/2,z-1 |
3_454 |
32 |
10 |
11516 |
220.1 |
-4.9 |
0.387 |
0 |
0 |
0 |
0.110 |
Average: |
228.8 |
-4.1 |
0.416 |
2 |
1 |
0 |
0.110 |
10 |
24 |
|
B |
27 |
10 |
12579 |
◊ |
E |
-x+1/2,y-1/2,-z+2 |
4_547 |
23 |
7 |
11544 |
204.9 |
-3.2 |
0.369 |
1 |
1 |
0 |
0.000 |
11 |
25 |
|
A |
15 |
6 |
12762 |
◊ |
B |
x,y,z-1 |
1_554 |
15 |
5 |
12579 |
163.4 |
-4.3 |
0.141 |
0 |
0 |
0 |
0.101 |
26 |
|
C |
18 |
7 |
12669 |
◊ |
C |
-x+1,y,-z+2 |
2_657 |
18 |
7 |
12669 |
128.5 |
-2.1 |
0.501 |
0 |
0 |
0 |
0.101 |
Average: |
145.9 |
-3.2 |
0.321 |
0 |
0 |
0 |
0.101 |
12 |
27 |
|
C |
13 |
5 |
12669 |
◊ |
C |
-x+1,y,-z+3 |
2_658 |
13 |
5 |
12669 |
142.2 |
3.1 |
0.966 |
0 |
2 |
0 |
0.000 |
28 |
|
B |
11 |
5 |
12579 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
12762 |
118.3 |
0.6 |
0.750 |
0 |
0 |
0 |
0.000 |
Average: |
130.3 |
1.9 |
0.858 |
0 |
1 |
0 |
0.000 |
13 |
29 |
|
[OHT]C:502 |
3 |
1 |
639 |
f |
I |
x,y,z |
1_555 |
6 |
3 |
1455 |
63.8 |
-1.8 |
0.235 |
0 |
0 |
0 |
0.100 |
30 |
|
[OHT]A:500 |
4 |
1 |
637 |
f |
G |
x,y,z |
1_555 |
7 |
3 |
1381 |
60.5 |
-1.5 |
0.276 |
0 |
0 |
0 |
0.100 |
31 |
|
[OHT]B:501 |
3 |
1 |
639 |
f |
H |
x,y,z |
1_555 |
6 |
3 |
1347 |
52.9 |
-1.4 |
0.299 |
0 |
0 |
0 |
0.100 |
Average: |
59.1 |
-1.6 |
0.270 |
0 |
0 |
0 |
0.100 |
14 |
32 |
|
[OHT]F:505 |
2 |
1 |
635 |
f |
C |
-x+1,y,-z+3 |
2_658 |
5 |
3 |
12669 |
40.8 |
-1.0 |
0.253 |
0 |
0 |
0 |
0.100 |
33 |
|
[OHT]D:503 |
2 |
1 |
639 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
12579 |
40.2 |
-0.4 |
0.336 |
0 |
0 |
0 |
0.100 |
34 |
|
[OHT]E:504 |
2 |
1 |
629 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
12762 |
35.8 |
-0.8 |
0.252 |
0 |
0 |
0 |
0.100 |
Average: |
38.9 |
-0.7 |
0.280 |
0 |
0 |
0 |
0.100 |
15 |
35 |
|
A |
5 |
2 |
12762 |
◊ |
C |
x,y,z-1 |
1_554 |
6 |
3 |
12669 |
26.4 |
-0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
16 |
36 |
|
D |
2 |
1 |
11610 |
◊ |
E |
x,y,z-1 |
1_554 |
1 |
1 |
11544 |
14.5 |
0.9 |
0.935 |
0 |
0 |
0 |
0.000 |
37 |
|
F |
1 |
1 |
11516 |
◊ |
F |
-x+1,y,-z+2 |
2_657 |
1 |
1 |
11516 |
10.9 |
0.5 |
0.912 |
0 |
0 |
0 |
0.000 |
Average: |
12.7 |
0.7 |
0.923 |
0 |
0 |
0 |
0.000 |
17 |
38 |
|
F |
2 |
2 |
11516 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
3 |
2 |
12762 |
2.4 |
-0.0 |
0.646 |
0 |
0 |
0 |
0.000 |
|