| ## |
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 |
38 |
15 |
12780 |
◊ |
A |
x,y,z |
1_555 |
38 |
15 |
12848 |
330.5 |
-4.2 |
0.242 |
2 |
0 |
0 |
0.000 |
| 2 |
2 |
|
B |
42 |
14 |
12780 |
x |
B |
-y+1,x-y+1,z+1/3 |
2_665 |
42 |
13 |
12780 |
325.0 |
-0.4 |
0.682 |
4 |
0 |
0 |
0.000 |
3 |
|
A |
39 |
12 |
12848 |
x |
A |
-y,x-y+1,z+1/3 |
2_565 |
39 |
13 |
12848 |
319.0 |
-0.3 |
0.685 |
5 |
0 |
0 |
0.000 |
| Average: |
322.0 |
-0.3 |
0.683 |
5 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
22 |
9 |
12780 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
28 |
11 |
12848 |
263.4 |
-3.9 |
0.159 |
3 |
0 |
0 |
0.000 |
5 |
|
B |
28 |
10 |
12780 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
22 |
9 |
12848 |
259.5 |
-3.0 |
0.242 |
4 |
1 |
0 |
0.000 |
| Average: |
261.5 |
-3.5 |
0.200 |
4 |
1 |
0 |
0.000 |
| 4 |
6 |
|
[BGC]A:502 |
11 |
1 |
297 |
◊ |
A |
x,y,z |
1_555 |
32 |
9 |
12848 |
167.5 |
2.2 |
0.418 |
0 |
0 |
0 |
0.000 |
7 |
|
[BGC]B:502 |
11 |
1 |
293 |
◊ |
B |
x,y,z |
1_555 |
32 |
9 |
12780 |
166.9 |
2.2 |
0.407 |
0 |
0 |
0 |
0.000 |
| Average: |
167.2 |
2.2 |
0.413 |
0 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[XYS]B:505 |
9 |
1 |
259 |
◊ |
B |
x,y,z |
1_555 |
26 |
11 |
12780 |
139.8 |
2.6 |
0.495 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[XYS]A:505 |
9 |
1 |
260 |
◊ |
A |
x,y,z |
1_555 |
26 |
10 |
12848 |
139.0 |
2.4 |
0.503 |
1 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[BGC]B:503 |
11 |
1 |
294 |
◊ |
B |
x,y,z |
1_555 |
20 |
3 |
12780 |
120.2 |
1.1 |
0.203 |
0 |
0 |
0 |
0.000 |
11 |
|
[BGC]A:503 |
11 |
1 |
293 |
◊ |
A |
x,y,z |
1_555 |
20 |
3 |
12848 |
117.5 |
1.0 |
0.202 |
0 |
0 |
0 |
0.000 |
| Average: |
118.8 |
1.0 |
0.202 |
0 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[BGC]B:504 |
11 |
1 |
309 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
12780 |
77.8 |
0.3 |
0.141 |
0 |
0 |
0 |
0.000 |
13 |
|
[BGC]A:504 |
10 |
1 |
310 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
12848 |
76.5 |
0.4 |
0.154 |
0 |
0 |
0 |
0.000 |
| Average: |
77.1 |
0.3 |
0.148 |
0 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[BGC]B:504 |
7 |
1 |
309 |
cf |
[BGC]B:503 |
x,y,z |
1_555 |
6 |
1 |
294 |
64.0 |
1.1 |
0.109 |
1 |
0 |
0 |
0.000 |
15 |
|
[BGC]A:504 |
6 |
1 |
310 |
cf |
[BGC]A:503 |
x,y,z |
1_555 |
6 |
1 |
293 |
63.3 |
1.2 |
0.130 |
1 |
0 |
0 |
0.000 |
| Average: |
63.6 |
1.1 |
0.119 |
1 |
0 |
0 |
0.000 |
| 10 |
16 |
|
[BGC]B:503 |
5 |
1 |
294 |
cf |
[BGC]B:502 |
x,y,z |
1_555 |
6 |
1 |
293 |
60.6 |
0.9 |
0.139 |
1 |
0 |
0 |
0.000 |
17 |
|
[BGC]A:503 |
5 |
1 |
293 |
cf |
[BGC]A:502 |
x,y,z |
1_555 |
7 |
1 |
297 |
59.7 |
0.9 |
0.125 |
0 |
0 |
0 |
0.000 |
| Average: |
60.1 |
0.9 |
0.132 |
1 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[XYS]A:505 |
7 |
1 |
260 |
cf |
[BGC]A:502 |
x,y,z |
1_555 |
5 |
1 |
297 |
50.0 |
2.0 |
0.245 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[XYS]B:505 |
6 |
1 |
259 |
cf |
[BGC]B:502 |
x,y,z |
1_555 |
4 |
1 |
293 |
49.6 |
2.0 |
0.257 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[XYS]A:505 |
5 |
1 |
260 |
f |
[BGC]A:503 |
x,y,z |
1_555 |
4 |
1 |
293 |
44.4 |
0.8 |
0.213 |
0 |
0 |
0 |
0.000 |
21 |
|
[XYS]B:505 |
5 |
1 |
259 |
f |
[BGC]B:503 |
x,y,z |
1_555 |
4 |
1 |
294 |
41.4 |
0.7 |
0.202 |
0 |
0 |
0 |
0.000 |
| Average: |
42.9 |
0.7 |
0.208 |
0 |
0 |
0 |
0.000 |
| 14 |
22 |
|
[MG]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
12780 |
38.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
1.000 |
23 |
|
[MG]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12848 |
35.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
36.9 |
-3.9 |
0.000 |
0 |
0 |
0 |
1.000 |
| 15 |
24 |
|
[MG]A:501 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
12780 |
30.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[MG]B:501 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
12848 |
26.9 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
28.6 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 16 |
26 |
|
[XYS]A:505 |
1 |
1 |
260 |
f |
[BGC]A:504 |
x,y,z |
1_555 |
2 |
1 |
310 |
5.7 |
-0.3 |
0.236 |
0 |
0 |
0 |
0.000 |
| 17 |
27 |
|
A |
2 |
1 |
12848 |
f |
[BGC]A:503 |
-y,x-y+1,z+1/3 |
2_565 |
1 |
1 |
293 |
5.7 |
0.1 |
0.365 |
0 |
0 |
0 |
0.000 |
28 |
|
[BGC]B:503 |
1 |
1 |
294 |
f |
B |
-y+1,x-y+1,z+1/3 |
2_665 |
2 |
1 |
12780 |
4.8 |
0.1 |
0.362 |
0 |
0 |
0 |
0.000 |
| Average: |
5.2 |
0.1 |
0.364 |
0 |
0 |
0 |
0.000 |
| 18 |
29 |
|
[XYS]B:505 |
1 |
1 |
259 |
f |
[BGC]B:504 |
x,y,z |
1_555 |
1 |
1 |
309 |
3.1 |
-0.1 |
0.192 |
0 |
0 |
0 |
0.041 |
|