| ## |
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 |
106 |
27 |
4535 |
◊ |
B |
x,y,z |
1_555 |
107 |
27 |
4790 |
1147.9 |
-24.3 |
0.376 |
12 |
4 |
1 |
0.589 |
2 |
|
B |
113 |
27 |
4790 |
◊ |
A |
x,y,z |
1_555 |
103 |
26 |
4557 |
1134.4 |
-22.5 |
0.445 |
11 |
2 |
1 |
0.589 |
3 |
|
E |
101 |
27 |
4621 |
◊ |
D |
x,y,z |
1_555 |
104 |
25 |
4664 |
1077.0 |
-21.8 |
0.399 |
11 |
5 |
1 |
0.589 |
| Average: |
1119.8 |
-22.9 |
0.407 |
11 |
4 |
1 |
0.589 |
| 2 |
4 |
|
E |
99 |
25 |
4621 |
◊ |
A |
x,y,z |
1_555 |
107 |
27 |
4557 |
1088.4 |
-22.8 |
0.397 |
10 |
3 |
1 |
0.397 |
5 |
|
D |
111 |
27 |
4664 |
◊ |
C |
x,y,z |
1_555 |
94 |
26 |
4535 |
1081.7 |
-23.8 |
0.366 |
13 |
2 |
1 |
0.397 |
| Average: |
1085.1 |
-23.3 |
0.381 |
12 |
3 |
1 |
0.397 |
| 3 |
6 |
|
B |
21 |
6 |
4790 |
◊ |
E |
-x+2,y-1/2,-z-1 |
2_744 |
28 |
8 |
4621 |
226.0 |
-2.0 |
0.713 |
0 |
1 |
0 |
0.000 |
| 4 |
7 |
|
C |
28 |
9 |
4535 |
◊ |
E |
-x+2,y-1/2,-z |
2_745 |
21 |
6 |
4621 |
204.9 |
-1.5 |
0.806 |
1 |
2 |
0 |
0.000 |
| 5 |
8 |
|
B |
19 |
7 |
4790 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
18 |
5 |
4557 |
179.6 |
-0.9 |
0.709 |
0 |
0 |
0 |
0.000 |
| 6 |
9 |
|
C |
21 |
4 |
4535 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
19 |
6 |
4557 |
178.6 |
1.0 |
0.931 |
3 |
6 |
0 |
0.000 |
| 7 |
10 |
|
A |
16 |
4 |
4557 |
◊ |
C |
x-1,y,z |
1_455 |
16 |
5 |
4535 |
160.8 |
1.1 |
0.869 |
1 |
1 |
0 |
0.000 |
| 8 |
11 |
|
A |
19 |
6 |
4557 |
◊ |
E |
-x+2,y-1/2,-z-1 |
2_744 |
15 |
5 |
4621 |
158.8 |
-1.9 |
0.630 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
B |
14 |
6 |
4790 |
◊ |
E |
-x+2,y-1/2,-z |
2_745 |
13 |
4 |
4621 |
140.4 |
0.5 |
0.831 |
1 |
0 |
0 |
0.000 |
| 10 |
13 |
|
C |
14 |
5 |
4535 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
13 |
4 |
4557 |
140.3 |
-1.5 |
0.679 |
1 |
2 |
0 |
0.000 |
| 11 |
14 |
|
B |
14 |
5 |
4790 |
◊ |
D |
x-1,y,z |
1_455 |
15 |
5 |
4664 |
126.8 |
1.5 |
0.895 |
2 |
1 |
0 |
0.000 |
| 12 |
15 |
|
A |
11 |
3 |
4557 |
◊ |
D |
x,y,z-1 |
1_554 |
8 |
4 |
4664 |
84.6 |
-0.8 |
0.689 |
1 |
1 |
0 |
0.000 |
| 13 |
16 |
|
B |
12 |
5 |
4790 |
◊ |
C |
x-1,y,z |
1_455 |
9 |
6 |
4535 |
77.5 |
1.6 |
0.886 |
1 |
0 |
0 |
0.000 |
| 14 |
17 |
|
E |
5 |
2 |
4621 |
◊ |
D |
x,y,z-1 |
1_554 |
8 |
3 |
4664 |
59.0 |
-0.5 |
0.657 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
D |
2 |
1 |
4664 |
◊ |
C |
x-1,y,z+1 |
1_456 |
6 |
2 |
4535 |
52.4 |
-1.2 |
0.189 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
A |
6 |
4 |
4557 |
◊ |
D |
-x+2,y-1/2,-z-1 |
2_744 |
6 |
2 |
4664 |
51.9 |
-0.7 |
0.581 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
B |
5 |
2 |
4790 |
◊ |
D |
-x+2,y-1/2,-z-1 |
2_744 |
8 |
3 |
4664 |
51.8 |
0.9 |
0.826 |
2 |
0 |
0 |
0.000 |
| 18 |
21 |
|
E |
3 |
2 |
4621 |
x |
E |
x,y,z-1 |
1_554 |
4 |
2 |
4621 |
49.9 |
-1.1 |
0.343 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
B |
4 |
1 |
4790 |
◊ |
E |
x-1,y,z+1 |
1_456 |
9 |
3 |
4621 |
46.7 |
-1.1 |
0.420 |
0 |
0 |
0 |
0.000 |
23 |
|
C |
1 |
1 |
4535 |
◊ |
A |
x-1,y,z+1 |
1_456 |
6 |
2 |
4557 |
22.8 |
-0.7 |
0.345 |
0 |
0 |
0 |
0.000 |
| Average: |
34.7 |
-0.9 |
0.382 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
A |
6 |
3 |
4557 |
◊ |
E |
x,y,z-1 |
1_554 |
4 |
2 |
4621 |
43.7 |
-1.4 |
0.391 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
C |
4 |
4 |
4535 |
◊ |
E |
-x+1,y-1/2,-z |
2_645 |
5 |
3 |
4621 |
42.5 |
0.8 |
0.829 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
E |
6 |
6 |
4621 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
4790 |
35.9 |
-0.8 |
0.588 |
0 |
0 |
0 |
0.013 |
27 |
|
D |
5 |
5 |
4664 |
◊ |
B |
x,y,z |
1_555 |
6 |
5 |
4790 |
28.6 |
-0.6 |
0.600 |
0 |
0 |
0 |
0.013 |
28 |
|
D |
4 |
3 |
4664 |
◊ |
A |
x,y,z |
1_555 |
4 |
4 |
4557 |
26.3 |
-0.5 |
0.576 |
0 |
0 |
0 |
0.013 |
29 |
|
C |
6 |
4 |
4535 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
4557 |
14.7 |
-0.2 |
0.718 |
0 |
0 |
0 |
0.013 |
| Average: |
26.4 |
-0.5 |
0.621 |
0 |
0 |
0 |
0.013 |
| 23 |
30 |
|
B |
2 |
1 |
4790 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
5 |
2 |
4557 |
32.8 |
-1.7 |
0.175 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
C |
5 |
4 |
4535 |
◊ |
D |
-x+2,y-1/2,-z |
2_745 |
5 |
2 |
4664 |
31.7 |
0.6 |
0.744 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
[CL]A:500 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
4790 |
26.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.071 |
33 |
|
[CL]A:500 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
4557 |
26.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.071 |
34 |
|
[CL]A:500 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
4621 |
26.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.071 |
35 |
|
[CL]A:500 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
4664 |
25.6 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.071 |
36 |
|
[CL]A:500 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
4535 |
24.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.071 |
| Average: |
26.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.071 |
| 26 |
37 |
|
B |
3 |
1 |
4790 |
◊ |
A |
-x+2,y-1/2,-z-1 |
2_744 |
4 |
2 |
4557 |
23.3 |
0.5 |
0.822 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
D |
2 |
1 |
4664 |
◊ |
E |
-x+2,y-1/2,-z |
2_745 |
2 |
2 |
4621 |
16.6 |
0.5 |
0.846 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
C |
1 |
1 |
4535 |
◊ |
E |
x-1,y,z+1 |
1_456 |
4 |
1 |
4621 |
16.2 |
-0.3 |
0.413 |
0 |
0 |
0 |
0.000 |
| 29 |
40 |
|
D |
2 |
1 |
4664 |
◊ |
B |
x-1,y,z+1 |
1_456 |
3 |
1 |
4790 |
15.7 |
-0.4 |
0.455 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
E |
4 |
4 |
4621 |
◊ |
C |
x,y,z |
1_555 |
5 |
4 |
4535 |
14.1 |
-0.2 |
0.709 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
B |
1 |
1 |
4790 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
4790 |
11.2 |
-0.1 |
0.625 |
0 |
0 |
0 |
0.000 |
| 32 |
43 |
|
E |
2 |
1 |
4621 |
◊ |
D |
x-1,y,z+1 |
1_456 |
1 |
1 |
4664 |
10.9 |
0.0 |
0.654 |
0 |
0 |
0 |
0.000 |
| 33 |
44 |
|
A |
2 |
1 |
4557 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
4664 |
9.2 |
-0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
| 34 |
45 |
|
E |
2 |
1 |
4621 |
◊ |
C |
x-1,y,z+1 |
1_456 |
2 |
1 |
4535 |
8.7 |
-0.2 |
0.525 |
0 |
0 |
0 |
0.000 |
| 35 |
46 |
|
B |
1 |
1 |
4790 |
◊ |
D |
x-1,y,z+1 |
1_456 |
1 |
1 |
4664 |
7.8 |
-0.0 |
0.547 |
0 |
0 |
0 |
0.000 |
|