## |
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 |
282 |
75 |
15120 |
◊ |
A |
x,y,z |
1_555 |
283 |
75 |
15316 |
2798.7 |
-16.1 |
0.275 |
57 |
15 |
0 |
0.580 |
2 |
2 |
|
B |
51 |
18 |
15120 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
61 |
20 |
15316 |
502.8 |
0.4 |
0.704 |
2 |
4 |
0 |
0.000 |
3 |
3 |
|
B |
61 |
19 |
15120 |
◊ |
A |
x,y,z-1 |
1_554 |
60 |
18 |
15316 |
478.7 |
-3.6 |
0.397 |
3 |
3 |
0 |
0.000 |
4 |
4 |
|
[NAP]B:402 |
39 |
1 |
829 |
f |
B |
x,y,z |
1_555 |
52 |
21 |
15120 |
446.0 |
-2.6 |
0.509 |
14 |
0 |
0 |
0.117 |
5 |
5 |
|
[NAP]A:402 |
37 |
1 |
829 |
f |
A |
x,y,z |
1_555 |
48 |
22 |
15316 |
409.9 |
-2.6 |
0.484 |
15 |
0 |
0 |
0.123 |
6 |
6 |
|
A |
28 |
11 |
15316 |
x |
A |
x-1,y,z |
1_455 |
25 |
8 |
15316 |
236.1 |
-2.1 |
0.328 |
2 |
2 |
0 |
0.000 |
7 |
7 |
|
[4NO]A:401 |
16 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
31 |
15 |
15316 |
213.4 |
3.9 |
0.482 |
9 |
0 |
0 |
0.004 |
8 |
|
[4NO]B:401 |
16 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
33 |
15 |
15120 |
211.8 |
3.8 |
0.471 |
9 |
0 |
0 |
0.004 |
Average: |
212.6 |
3.9 |
0.476 |
9 |
0 |
0 |
0.004 |
8 |
9 |
|
[NAP]B:402 |
14 |
1 |
829 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
21 |
7 |
15316 |
151.8 |
-2.0 |
0.410 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
12 |
5 |
15316 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
4 |
15120 |
110.1 |
-0.1 |
0.580 |
1 |
2 |
0 |
0.000 |
10 |
11 |
|
[EDO]B:405 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
15120 |
109.9 |
4.0 |
0.481 |
3 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]A:407 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
15316 |
109.3 |
3.9 |
0.482 |
3 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:406 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
15316 |
107.0 |
3.0 |
0.412 |
3 |
0 |
0 |
0.000 |
13 |
14 |
|
[ACT]A:403 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
15316 |
106.4 |
0.4 |
0.788 |
1 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]B:404 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
15120 |
104.9 |
2.9 |
0.417 |
3 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:409 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
15316 |
96.8 |
2.5 |
0.259 |
3 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]B:406 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
15120 |
70.0 |
2.1 |
0.506 |
1 |
0 |
0 |
0.000 |
17 |
18 |
|
[NA]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
15120 |
66.9 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.137 |
18 |
19 |
|
[EDO]A:410 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
15316 |
60.0 |
1.8 |
0.843 |
1 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]A:408 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
15120 |
57.0 |
1.5 |
0.851 |
1 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]A:410 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
15120 |
55.5 |
0.9 |
0.798 |
1 |
0 |
0 |
0.000 |
21 |
22 |
|
A |
6 |
2 |
15316 |
x |
A |
-x,y-1/2,-z |
2_545 |
6 |
2 |
15316 |
54.1 |
-0.5 |
0.323 |
0 |
0 |
0 |
0.000 |
22 |
23 |
|
[EDO]A:408 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
15316 |
53.9 |
0.9 |
0.778 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
[NA]A:404 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
15316 |
53.4 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.228 |
25 |
|
B |
11 |
7 |
15120 |
f |
[NA]A:405 |
x,y,z-1 |
1_554 |
1 |
1 |
125 |
53.0 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.228 |
Average: |
53.2 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.228 |
24 |
26 |
|
[EDO]B:406 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
15316 |
49.4 |
1.0 |
0.178 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
B |
7 |
2 |
15120 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
7 |
3 |
15316 |
46.6 |
0.6 |
0.756 |
0 |
2 |
0 |
0.000 |
26 |
28 |
|
[NA]A:405 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
15316 |
37.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
7 |
4 |
15120 |
◊ |
[NA]A:404 |
x,y,z-1 |
1_554 |
1 |
1 |
125 |
37.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
37.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
B |
4 |
4 |
15120 |
f |
[EDO]A:409 |
x,y,z-1 |
1_554 |
2 |
1 |
182 |
35.9 |
0.8 |
0.395 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[EDO]B:406 |
2 |
1 |
185 |
f |
[NA]B:403 |
x,y,z |
1_555 |
1 |
1 |
125 |
12.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.015 |
|