| ## |
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 |
|
D |
168 |
46 |
7396 |
◊ |
B |
x,y,z |
1_555 |
168 |
48 |
7402 |
1513.7 |
-17.7 |
0.505 |
9 |
1 |
0 |
1.000 |
| 2 |
2 |
|
B |
67 |
18 |
7402 |
◊ |
B |
-x+1,y,-z |
3_655 |
66 |
18 |
7402 |
600.6 |
-8.3 |
0.413 |
1 |
0 |
0 |
0.161 |
| 3 |
3 |
|
D |
37 |
11 |
7396 |
◊ |
B |
x,-y,-z |
4_555 |
37 |
11 |
7402 |
414.7 |
-9.5 |
0.061 |
1 |
0 |
0 |
0.481 |
| 4 |
4 |
|
P |
37 |
7 |
1130 |
◊ |
D |
x,y,z |
1_555 |
54 |
18 |
7396 |
397.6 |
-5.4 |
0.591 |
0 |
0 |
0 |
0.261 |
| 5 |
5 |
|
M |
36 |
6 |
1153 |
◊ |
B |
x,y,z |
1_555 |
53 |
19 |
7402 |
375.7 |
-5.1 |
0.616 |
0 |
0 |
0 |
0.249 |
| 6 |
6 |
|
B |
25 |
4 |
7402 |
◊ |
D |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
28 |
10 |
7396 |
250.8 |
-0.8 |
0.626 |
2 |
0 |
0 |
0.000 |
| 7 |
7 |
|
D |
16 |
4 |
7396 |
◊ |
D |
-x,y,-z |
3_555 |
16 |
4 |
7396 |
200.1 |
-4.1 |
0.172 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
D |
20 |
6 |
7396 |
◊ |
D |
x,-y,-z |
4_555 |
20 |
6 |
7396 |
183.8 |
0.1 |
0.788 |
0 |
0 |
0 |
0.018 |
9 |
|
B |
19 |
5 |
7402 |
◊ |
B |
x,-y,-z |
4_555 |
19 |
5 |
7402 |
183.2 |
-0.8 |
0.668 |
1 |
0 |
0 |
0.018 |
| Average: |
183.5 |
-0.4 |
0.728 |
1 |
0 |
0 |
0.018 |
| 9 |
10 |
|
D |
18 |
6 |
7396 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
14 |
5 |
7402 |
134.4 |
-2.4 |
0.383 |
1 |
0 |
0 |
0.000 |
| 10 |
11 |
|
P |
13 |
3 |
1130 |
◊ |
P |
x,-y,-z+1 |
4_556 |
13 |
3 |
1130 |
132.5 |
-2.2 |
0.599 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[LEA]M:2 |
6 |
1 |
253 |
cf |
M |
x,y,z |
1_555 |
13 |
5 |
1153 |
122.5 |
2.6 |
0.045 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
M |
17 |
5 |
1153 |
◊ |
D |
x,-y,-z |
4_555 |
14 |
2 |
7396 |
116.9 |
-2.8 |
0.391 |
0 |
0 |
0 |
0.273 |
14 |
|
P |
15 |
4 |
1130 |
◊ |
B |
x,-y,-z |
4_555 |
13 |
2 |
7402 |
114.7 |
-2.8 |
0.384 |
0 |
0 |
0 |
0.273 |
| Average: |
115.8 |
-2.8 |
0.388 |
0 |
0 |
0 |
0.273 |
| 13 |
15 |
|
[LEA]P:2 |
6 |
1 |
250 |
cf |
P |
x,y,z |
1_555 |
11 |
4 |
1130 |
106.3 |
2.1 |
0.034 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
M |
11 |
4 |
1153 |
◊ |
B |
-x+1,y,-z |
3_655 |
7 |
2 |
7402 |
82.9 |
-1.5 |
0.497 |
0 |
0 |
0 |
0.053 |
| 15 |
17 |
|
D |
6 |
3 |
7396 |
◊ |
B |
x,-y,-z+1 |
4_556 |
8 |
3 |
7402 |
79.6 |
-0.7 |
0.486 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
B |
9 |
3 |
7402 |
◊ |
B |
x,-y,-z+1 |
4_556 |
9 |
3 |
7402 |
77.9 |
0.1 |
0.742 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
D |
6 |
2 |
7396 |
x |
D |
x,y,z-1 |
1_554 |
5 |
3 |
7396 |
54.2 |
-0.8 |
0.423 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[NH2]M:10 |
1 |
1 |
117 |
cf |
M |
x,y,z |
1_555 |
5 |
2 |
1153 |
51.6 |
0.3 |
0.773 |
0 |
0 |
0 |
0.000 |
21 |
|
[NH2]P:10 |
1 |
1 |
117 |
cf |
P |
x,y,z |
1_555 |
5 |
1 |
1130 |
49.0 |
0.2 |
0.747 |
0 |
0 |
0 |
0.000 |
| Average: |
50.3 |
0.3 |
0.760 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
P |
8 |
2 |
1130 |
◊ |
D |
x,-y,-z+1 |
4_556 |
3 |
2 |
7396 |
51.0 |
-1.2 |
0.253 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[NH2]P:10 |
1 |
1 |
117 |
◊ |
D |
x,-y,-z+1 |
4_556 |
3 |
1 |
7396 |
39.0 |
-0.0 |
0.468 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
D |
6 |
2 |
7396 |
◊ |
B |
-x+1,-y,z |
2_655 |
2 |
2 |
7402 |
37.2 |
-0.8 |
0.331 |
0 |
0 |
0 |
0.028 |
| 22 |
25 |
|
[LEA]P:2 |
5 |
1 |
250 |
◊ |
[LEA]P:2 |
x,-y,-z+1 |
4_556 |
5 |
1 |
250 |
36.9 |
2.3 |
1.000 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[LEA]P:2 |
2 |
1 |
250 |
◊ |
P |
x,-y,-z+1 |
4_556 |
2 |
1 |
1130 |
25.3 |
0.0 |
0.051 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
M |
5 |
1 |
1153 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
2 |
7402 |
19.0 |
-0.5 |
0.425 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
D |
3 |
1 |
7396 |
x |
D |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
7396 |
18.7 |
0.4 |
0.809 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
B |
2 |
1 |
7402 |
x |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
7402 |
12.7 |
0.1 |
0.584 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
P |
1 |
1 |
1130 |
◊ |
P |
-x,-y,z |
2_555 |
1 |
1 |
1130 |
11.4 |
0.8 |
0.909 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
P |
1 |
1 |
1130 |
◊ |
P |
-x,y,-z+1 |
3_556 |
1 |
1 |
1130 |
10.2 |
0.8 |
0.909 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[NH2]P:10 |
1 |
1 |
117 |
◊ |
P |
x,-y,-z+1 |
4_556 |
3 |
2 |
1130 |
10.0 |
-0.1 |
0.794 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[LEA]M:2 |
1 |
1 |
253 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7402 |
3.9 |
0.2 |
0.921 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[NH2]M:10 |
1 |
1 |
117 |
◊ |
B |
-x+1,y,-z |
3_655 |
2 |
1 |
7402 |
3.5 |
-0.0 |
0.734 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
B |
1 |
1 |
7402 |
◊ |
D |
x,y,z-1 |
1_554 |
1 |
1 |
7396 |
2.4 |
0.1 |
0.779 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[LEA]M:2 |
1 |
1 |
253 |
◊ |
D |
x,-y,-z |
4_555 |
1 |
1 |
7396 |
1.3 |
0.0 |
0.683 |
0 |
0 |
0 |
0.000 |
|