| ## |
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 |
|
A |
68 |
19 |
19223 |
x |
A |
-y-1,x+1,z |
3_465 |
83 |
24 |
19223 |
639.0 |
-0.8 |
0.592 |
2 |
1 |
0 |
0.000 |
| 2 |
2 |
|
[EDO]A:610 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
19223 |
111.9 |
3.2 |
0.521 |
0 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[XYS]A:604 |
8 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
19223 |
109.3 |
3.1 |
0.560 |
0 |
0 |
0 |
0.000 |
| 4 |
4 |
|
[EDO]A:611 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
19223 |
102.6 |
3.8 |
0.554 |
1 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[BGC]A:607 |
9 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
19223 |
98.6 |
1.6 |
0.338 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[EDO]A:614 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
19223 |
97.3 |
2.3 |
0.390 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[BGC]A:603 |
6 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
19223 |
95.3 |
1.1 |
0.379 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[BGC]A:606 |
8 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
20 |
5 |
19223 |
91.2 |
1.6 |
0.339 |
0 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[BGC]A:608 |
9 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
19223 |
86.5 |
0.5 |
0.129 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[BGC]A:609 |
10 |
1 |
301 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
19223 |
86.4 |
0.6 |
0.169 |
0 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[BGC]A:602 |
8 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
12 |
2 |
19223 |
85.7 |
0.1 |
0.158 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[EDO]A:613 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
19223 |
78.6 |
2.0 |
0.275 |
0 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[EDO]A:612 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
19223 |
73.8 |
2.2 |
0.289 |
0 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[CL]A:615 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
19223 |
71.2 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 15 |
15 |
|
[BGC]A:602 |
5 |
1 |
295 |
cf |
[BGC]A:601 |
x,y,z |
1_555 |
5 |
1 |
295 |
62.0 |
1.0 |
0.198 |
0 |
0 |
0 |
0.000 |
16 |
|
[BGC]A:607 |
5 |
1 |
292 |
cf |
[BGC]A:606 |
x,y,z |
1_555 |
6 |
1 |
294 |
57.1 |
1.2 |
0.153 |
0 |
0 |
0 |
0.000 |
| Average: |
59.6 |
1.1 |
0.175 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[BGC]A:603 |
4 |
1 |
291 |
cf |
[BGC]A:602 |
x,y,z |
1_555 |
5 |
1 |
295 |
61.2 |
1.3 |
0.193 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[BGC]A:606 |
5 |
1 |
294 |
cf |
[BGC]A:603 |
x,y,z |
1_555 |
6 |
1 |
291 |
60.0 |
1.2 |
0.144 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[EDO]A:613 |
3 |
1 |
185 |
◊ |
A |
-y-1,x+1,z |
3_465 |
11 |
5 |
19223 |
59.8 |
1.7 |
0.252 |
1 |
0 |
0 |
0.000 |
| 19 |
20 |
|
[BGC]A:609 |
4 |
1 |
301 |
cf |
[BGC]A:608 |
x,y,z |
1_555 |
5 |
1 |
294 |
59.5 |
1.2 |
0.190 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[BGC]A:608 |
5 |
1 |
294 |
cf |
[BGC]A:607 |
x,y,z |
1_555 |
6 |
1 |
292 |
59.2 |
1.2 |
0.179 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[XYS]A:604 |
6 |
1 |
258 |
cf |
[BGC]A:606 |
x,y,z |
1_555 |
5 |
1 |
294 |
54.9 |
2.1 |
0.258 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[XYS]A:605 |
4 |
1 |
256 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
19223 |
51.0 |
1.4 |
0.526 |
0 |
0 |
0 |
0.000 |
| 23 |
24 |
|
[XYS]A:605 |
4 |
1 |
256 |
cf |
[BGC]A:607 |
x,y,z |
1_555 |
3 |
1 |
292 |
46.9 |
2.3 |
0.500 |
0 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[BGC]A:601 |
7 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
19223 |
45.9 |
0.6 |
0.211 |
0 |
0 |
0 |
0.000 |
| 25 |
26 |
|
[NA]A:616 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
19223 |
40.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
[NA]A:616 |
1 |
1 |
125 |
f |
A |
-y-1,x+1,z |
3_465 |
10 |
4 |
19223 |
37.6 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 27 |
28 |
|
[NA]A:616 |
1 |
1 |
125 |
◊ |
[EDO]A:613 |
x,y,z |
1_555 |
4 |
1 |
185 |
31.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 28 |
29 |
|
[XYS]A:604 |
3 |
1 |
258 |
f |
[BGC]A:607 |
x,y,z |
1_555 |
4 |
1 |
292 |
31.2 |
1.0 |
0.312 |
0 |
0 |
0 |
0.000 |
| 29 |
30 |
|
[XYS]A:605 |
3 |
1 |
256 |
f |
[BGC]A:608 |
x,y,z |
1_555 |
1 |
1 |
294 |
23.0 |
0.7 |
0.246 |
0 |
0 |
0 |
0.000 |
| 30 |
31 |
|
[XYS]A:604 |
4 |
1 |
258 |
f |
[BGC]A:603 |
x,y,z |
1_555 |
3 |
1 |
291 |
20.6 |
1.2 |
0.323 |
0 |
0 |
0 |
0.000 |
| 31 |
32 |
|
[XYS]A:605 |
3 |
1 |
256 |
f |
[BGC]A:606 |
x,y,z |
1_555 |
2 |
1 |
294 |
14.3 |
0.5 |
0.296 |
0 |
0 |
0 |
0.000 |
|