| ## |
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 |
|
C |
184 |
50 |
20090 |
◊ |
B |
x,y,z |
1_555 |
194 |
53 |
14002 |
1749.4 |
-6.5 |
0.571 |
18 |
5 |
0 |
0.372 |
2 |
|
D |
176 |
47 |
20118 |
◊ |
A |
x,y,z |
1_555 |
190 |
52 |
13998 |
1713.1 |
-7.0 |
0.539 |
18 |
4 |
0 |
0.372 |
| Average: |
1731.3 |
-6.7 |
0.555 |
18 |
5 |
0 |
0.372 |
| 2 |
3 |
|
B |
73 |
22 |
14002 |
◊ |
A |
x,y,z |
1_555 |
74 |
23 |
13998 |
676.0 |
-3.1 |
0.493 |
10 |
0 |
0 |
0.067 |
| 3 |
4 |
|
I |
58 |
5 |
1471 |
◊ |
D |
x,y,z |
1_555 |
64 |
20 |
20118 |
592.6 |
-9.4 |
0.293 |
9 |
0 |
0 |
0.337 |
| 4 |
5 |
|
A |
52 |
13 |
13998 |
◊ |
B |
x,y-1,z |
1_545 |
59 |
19 |
14002 |
498.6 |
-4.0 |
0.334 |
3 |
0 |
0 |
0.000 |
6 |
|
B |
52 |
12 |
14002 |
◊ |
A |
x-1,y+1,z |
1_465 |
56 |
18 |
13998 |
472.1 |
-4.0 |
0.332 |
4 |
0 |
0 |
0.000 |
| Average: |
485.3 |
-4.0 |
0.333 |
4 |
0 |
0 |
0.000 |
| 5 |
7 |
|
E |
48 |
5 |
1348 |
◊ |
D |
x,y,z |
1_555 |
50 |
18 |
20118 |
458.9 |
-1.1 |
0.702 |
7 |
0 |
0 |
0.123 |
| 6 |
8 |
|
G |
50 |
4 |
1174 |
◊ |
C |
x,y,z |
1_555 |
48 |
15 |
20090 |
442.9 |
-9.8 |
0.279 |
10 |
0 |
0 |
0.352 |
| 7 |
9 |
|
F |
45 |
4 |
1352 |
◊ |
C |
x,y,z |
1_555 |
51 |
18 |
20090 |
431.0 |
-1.2 |
0.704 |
6 |
0 |
0 |
0.112 |
| 8 |
10 |
|
[3AT]D:800 |
29 |
1 |
606 |
f |
D |
x,y,z |
1_555 |
64 |
23 |
20118 |
412.8 |
-2.7 |
0.499 |
8 |
0 |
0 |
0.181 |
| 9 |
11 |
|
[3AT]C:801 |
29 |
1 |
589 |
f |
C |
x,y,z |
1_555 |
61 |
23 |
20090 |
389.9 |
-2.2 |
0.504 |
8 |
0 |
0 |
0.166 |
| 10 |
12 |
|
I |
19 |
2 |
1471 |
◊ |
C |
x,y-1,z+1 |
1_546 |
18 |
6 |
20090 |
166.2 |
0.1 |
0.536 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
I |
19 |
2 |
1471 |
◊ |
G |
x,y-1,z+1 |
1_546 |
22 |
2 |
1174 |
158.1 |
5.1 |
0.886 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
A |
13 |
5 |
13998 |
◊ |
D |
x-1,y,z |
1_455 |
14 |
3 |
20118 |
131.2 |
2.1 |
0.866 |
3 |
2 |
0 |
0.000 |
15 |
|
B |
12 |
4 |
14002 |
◊ |
C |
x-1,y,z |
1_455 |
14 |
4 |
20090 |
120.9 |
1.9 |
0.822 |
1 |
1 |
0 |
0.000 |
| Average: |
126.1 |
2.0 |
0.844 |
2 |
2 |
0 |
0.000 |
| 13 |
16 |
|
[3AT]C:801 |
18 |
1 |
589 |
◊ |
F |
x,y,z |
1_555 |
11 |
1 |
1352 |
107.4 |
0.9 |
0.651 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[3AT]D:800 |
18 |
1 |
606 |
◊ |
E |
x,y,z |
1_555 |
11 |
1 |
1348 |
101.6 |
1.7 |
0.690 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
D |
10 |
5 |
20118 |
◊ |
G |
x,y-1,z+1 |
1_546 |
6 |
2 |
1174 |
46.6 |
-0.2 |
0.538 |
1 |
0 |
0 |
0.000 |
| 16 |
19 |
|
C |
7 |
4 |
20090 |
x |
C |
x-1,y,z |
1_455 |
5 |
3 |
20090 |
39.4 |
-0.3 |
0.483 |
0 |
0 |
0 |
0.000 |
20 |
|
D |
3 |
2 |
20118 |
x |
D |
x-1,y,z |
1_455 |
3 |
2 |
20118 |
18.2 |
-0.1 |
0.491 |
0 |
0 |
0 |
0.000 |
| Average: |
28.8 |
-0.2 |
0.487 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[CA]D:903 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
20118 |
33.0 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.227 |
22 |
|
[CA]C:901 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
20090 |
32.0 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.227 |
| Average: |
32.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.227 |
| 18 |
23 |
|
E |
4 |
1 |
1348 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
13998 |
31.0 |
0.9 |
0.718 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
C |
4 |
1 |
20090 |
◊ |
A |
x-1,y+1,z |
1_465 |
8 |
3 |
13998 |
30.4 |
0.2 |
0.699 |
0 |
0 |
0 |
0.000 |
25 |
|
D |
3 |
1 |
20118 |
◊ |
B |
x,y-1,z |
1_545 |
4 |
2 |
14002 |
18.1 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
| Average: |
24.2 |
0.3 |
0.727 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[CA]D:904 |
1 |
1 |
85 |
f |
[3AT]D:800 |
x,y,z |
1_555 |
5 |
1 |
606 |
26.9 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.155 |
27 |
|
[CA]C:902 |
1 |
1 |
85 |
f |
[3AT]C:801 |
x,y,z |
1_555 |
5 |
1 |
589 |
26.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.155 |
| Average: |
26.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.155 |
| 21 |
28 |
|
[CA]D:904 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
20118 |
25.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.147 |
29 |
|
[CA]C:902 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
20090 |
25.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.147 |
| Average: |
25.4 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.147 |
| 22 |
30 |
|
[CA]D:903 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
1348 |
23.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.104 |
| 23 |
31 |
|
[CA]C:901 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
1352 |
23.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.103 |
| 24 |
32 |
|
D |
2 |
2 |
20118 |
◊ |
C |
x,y,z |
1_555 |
3 |
3 |
20090 |
21.7 |
-0.1 |
0.547 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
D |
5 |
3 |
20118 |
◊ |
C |
x,y-1,z+1 |
1_546 |
4 |
3 |
20090 |
20.1 |
-0.0 |
0.510 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
C |
3 |
1 |
20090 |
◊ |
D |
x,y,z-1 |
1_554 |
2 |
1 |
20118 |
15.4 |
0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
| 27 |
35 |
|
[CA]D:904 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
1348 |
15.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.059 |
| 28 |
36 |
|
[CA]C:902 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
1352 |
13.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.057 |
| 29 |
37 |
|
A |
3 |
2 |
13998 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
3 |
20090 |
10.3 |
-0.3 |
0.419 |
0 |
0 |
0 |
0.000 |
38 |
|
B |
2 |
1 |
14002 |
◊ |
D |
x-1,y+1,z |
1_465 |
3 |
2 |
20118 |
5.7 |
-0.2 |
0.414 |
0 |
0 |
0 |
0.000 |
| Average: |
8.0 |
-0.3 |
0.416 |
0 |
0 |
0 |
0.000 |
| 30 |
39 |
|
[CA]C:902 |
1 |
1 |
85 |
f |
[CA]C:901 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.8 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.067 |
| 31 |
40 |
|
[CA]D:904 |
1 |
1 |
85 |
f |
[CA]D:903 |
x,y,z |
1_555 |
1 |
1 |
85 |
6.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.057 |
| 32 |
41 |
|
[CA]C:901 |
1 |
1 |
85 |
f |
[3AT]C:801 |
x,y,z |
1_555 |
4 |
1 |
589 |
5.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.029 |
|