| ## |
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 |
214 |
59 |
20245 |
◊ |
A |
x,y,z |
1_555 |
212 |
58 |
20325 |
1889.2 |
-27.7 |
0.042 |
10 |
0 |
0 |
0.939 |
| 2 |
2 |
|
B |
122 |
28 |
20245 |
◊ |
B |
-x,-y+1,z |
2_565 |
122 |
28 |
20245 |
1118.8 |
-7.7 |
0.440 |
18 |
6 |
0 |
0.654 |
3 |
|
A |
120 |
27 |
20325 |
◊ |
A |
-x,y,-z |
3_555 |
120 |
27 |
20325 |
1101.3 |
-6.8 |
0.466 |
14 |
8 |
0 |
0.654 |
| Average: |
1110.0 |
-7.3 |
0.453 |
16 |
7 |
0 |
0.654 |
| 3 |
4 |
|
B |
76 |
24 |
20245 |
◊ |
A |
-x,-y+1,z |
2_565 |
76 |
20 |
20325 |
755.4 |
-8.1 |
0.165 |
10 |
7 |
0 |
0.730 |
5 |
|
B |
77 |
22 |
20245 |
◊ |
A |
-x,y,-z |
3_555 |
73 |
24 |
20325 |
731.6 |
-6.5 |
0.297 |
11 |
8 |
0 |
0.730 |
| Average: |
743.5 |
-7.3 |
0.231 |
11 |
8 |
0 |
0.730 |
| 4 |
6 |
|
A |
58 |
17 |
20325 |
◊ |
A |
-x,-y+1,z |
2_565 |
59 |
17 |
20325 |
508.1 |
-4.9 |
0.387 |
4 |
2 |
0 |
0.080 |
7 |
|
B |
56 |
16 |
20245 |
◊ |
B |
-x,y,-z |
3_555 |
55 |
16 |
20245 |
497.9 |
-4.4 |
0.421 |
6 |
2 |
0 |
0.080 |
| Average: |
503.0 |
-4.6 |
0.404 |
5 |
2 |
0 |
0.080 |
| 5 |
8 |
|
B |
44 |
13 |
20245 |
◊ |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
52 |
15 |
20325 |
418.4 |
0.1 |
0.693 |
5 |
5 |
0 |
0.000 |
| 6 |
9 |
|
[OK8]A:502 |
29 |
1 |
598 |
f |
A |
x,y,z |
1_555 |
58 |
22 |
20325 |
388.7 |
-3.8 |
0.743 |
18 |
0 |
0 |
0.656 |
| 7 |
10 |
|
[C2R]B:802 |
21 |
1 |
467 |
f |
B |
x,y,z |
1_555 |
42 |
15 |
20245 |
293.0 |
-0.1 |
0.786 |
11 |
0 |
0 |
0.390 |
11 |
|
[C2R]A:501 |
21 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
39 |
15 |
20325 |
289.9 |
0.1 |
0.787 |
10 |
0 |
0 |
0.390 |
| Average: |
291.5 |
-0.0 |
0.787 |
11 |
0 |
0 |
0.390 |
| 8 |
12 |
|
[C2R]B:803 |
22 |
1 |
460 |
f |
B |
x,y,z |
1_555 |
43 |
16 |
20245 |
272.9 |
-2.6 |
0.662 |
11 |
0 |
0 |
0.590 |
| 9 |
13 |
|
[EDO]B:805 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
23 |
13 |
20245 |
126.5 |
3.5 |
0.634 |
3 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[EDO]A:504 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
20 |
13 |
20325 |
124.6 |
3.6 |
0.622 |
2 |
0 |
0 |
0.000 |
| 11 |
15 |
|
A |
16 |
8 |
20325 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
16 |
8 |
20325 |
123.5 |
-1.6 |
0.408 |
0 |
0 |
0 |
0.000 |
16 |
|
B |
19 |
9 |
20245 |
◊ |
B |
-x-1,y,-z |
3_455 |
19 |
9 |
20245 |
119.3 |
0.4 |
0.732 |
2 |
0 |
0 |
0.000 |
| Average: |
121.4 |
-0.6 |
0.570 |
1 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[EDO]A:506 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
20325 |
119.3 |
3.1 |
0.595 |
4 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[EDO]B:807 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
20245 |
116.6 |
3.1 |
0.602 |
4 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[EDO]B:808 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
12 |
20245 |
115.1 |
3.4 |
0.477 |
2 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[IMD]B:804 |
5 |
1 |
196 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
20245 |
99.2 |
2.8 |
0.329 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[IMD]A:503 |
5 |
1 |
196 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
20325 |
98.7 |
3.0 |
0.343 |
1 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[EDO]B:801 |
4 |
1 |
181 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
20325 |
91.3 |
3.0 |
0.548 |
3 |
0 |
0 |
0.000 |
| 18 |
23 |
|
B |
7 |
2 |
20245 |
◊ |
B |
-x,-y,z |
2_555 |
7 |
2 |
20245 |
89.5 |
-1.3 |
0.297 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[EDO]A:507 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
20245 |
88.5 |
3.0 |
0.323 |
2 |
0 |
0 |
0.000 |
| 20 |
25 |
|
[EDO]B:806 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
17 |
6 |
20245 |
85.9 |
2.4 |
0.288 |
1 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[C2R]A:501 |
14 |
1 |
467 |
◊ |
A |
-x,y,-z |
3_555 |
9 |
2 |
20325 |
85.3 |
-2.1 |
0.330 |
2 |
0 |
0 |
0.200 |
27 |
|
[C2R]B:802 |
15 |
1 |
467 |
◊ |
B |
-x,-y+1,z |
2_565 |
8 |
2 |
20245 |
82.2 |
-2.1 |
0.308 |
1 |
0 |
0 |
0.200 |
| Average: |
83.7 |
-2.1 |
0.319 |
2 |
0 |
0 |
0.200 |
| 22 |
28 |
|
[EDO]A:505 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
20325 |
85.0 |
2.3 |
0.288 |
1 |
0 |
0 |
0.000 |
| 23 |
29 |
|
[EDO]B:809 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
20245 |
82.2 |
1.7 |
0.244 |
3 |
0 |
0 |
0.000 |
| 24 |
30 |
|
[EDO]A:507 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
20325 |
63.8 |
1.8 |
0.271 |
1 |
0 |
0 |
0.000 |
| 25 |
31 |
|
[IMD]A:503 |
5 |
1 |
196 |
f |
[OK8]A:502 |
x,y,z |
1_555 |
12 |
1 |
598 |
61.2 |
0.4 |
0.108 |
1 |
0 |
0 |
0.005 |
| 26 |
32 |
|
[IMD]B:804 |
4 |
1 |
196 |
f |
[C2R]B:803 |
x,y,z |
1_555 |
9 |
1 |
460 |
58.9 |
0.7 |
0.125 |
1 |
0 |
0 |
0.000 |
| 27 |
33 |
|
[EDO]B:801 |
3 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
20245 |
58.2 |
1.6 |
0.267 |
1 |
0 |
0 |
0.000 |
| 28 |
34 |
|
[EDO]B:806 |
2 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
7 |
1 |
20325 |
34.6 |
0.4 |
0.707 |
0 |
0 |
0 |
0.000 |
| 29 |
35 |
|
[EDO]A:505 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
1 |
20245 |
30.7 |
0.3 |
0.717 |
0 |
0 |
0 |
0.000 |
| 30 |
36 |
|
A |
2 |
1 |
20325 |
x |
A |
x-1,y,z |
1_455 |
3 |
2 |
20325 |
25.3 |
0.6 |
0.516 |
0 |
0 |
0 |
0.000 |
37 |
|
B |
2 |
1 |
20245 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
20245 |
21.1 |
0.5 |
0.465 |
0 |
0 |
0 |
0.000 |
| Average: |
23.2 |
0.6 |
0.490 |
0 |
0 |
0 |
0.000 |
|