| ## |
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 |
137 |
34 |
18079 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
138 |
34 |
18079 |
1273.1 |
-15.7 |
0.056 |
16 |
6 |
0 |
0.153 |
2 |
|
B |
140 |
33 |
18139 |
◊ |
B |
-x,-x+y,-z+1/3 |
6_555 |
139 |
33 |
18139 |
1271.5 |
-16.1 |
0.053 |
12 |
2 |
0 |
0.153 |
| Average: |
1272.3 |
-15.9 |
0.055 |
14 |
4 |
0 |
0.153 |
| 2 |
3 |
|
B |
95 |
25 |
18139 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
94 |
24 |
18079 |
877.7 |
-5.3 |
0.383 |
15 |
2 |
0 |
0.073 |
| 3 |
4 |
|
A |
44 |
14 |
18079 |
◊ |
B |
x-y-1,-y-1,-z+2/3 |
5_445 |
37 |
14 |
18139 |
343.8 |
-2.3 |
0.423 |
1 |
2 |
0 |
0.000 |
| 4 |
5 |
|
A |
21 |
6 |
18079 |
◊ |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
19 |
6 |
18139 |
176.1 |
2.4 |
0.885 |
2 |
2 |
0 |
0.000 |
| 5 |
6 |
|
[MPD]A:505 |
7 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
34 |
12 |
18079 |
176.0 |
-11.5 |
0.520 |
2 |
0 |
0 |
0.159 |
7 |
|
[MPD]B:504 |
7 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
32 |
12 |
18139 |
174.6 |
-11.6 |
0.491 |
1 |
0 |
0 |
0.159 |
| Average: |
175.3 |
-11.6 |
0.506 |
2 |
0 |
0 |
0.159 |
| 6 |
8 |
|
[MPD]A:506 |
7 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
29 |
13 |
18079 |
170.1 |
-11.4 |
0.565 |
4 |
0 |
0 |
0.170 |
9 |
|
[MPD]B:506 |
7 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
30 |
14 |
18139 |
169.8 |
-11.4 |
0.569 |
4 |
0 |
0 |
0.170 |
| Average: |
170.0 |
-11.4 |
0.567 |
4 |
0 |
0 |
0.170 |
| 7 |
10 |
|
[TRS]A:507 |
7 |
1 |
255 |
f |
A |
x,y,z |
1_555 |
27 |
12 |
18079 |
138.0 |
2.8 |
0.385 |
7 |
0 |
0 |
0.004 |
| 8 |
11 |
|
[TRS]B:507 |
7 |
1 |
254 |
f |
B |
x,y,z |
1_555 |
27 |
12 |
18139 |
137.5 |
2.6 |
0.342 |
7 |
0 |
0 |
0.007 |
| 9 |
12 |
|
[MPD]B:505 |
7 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
18139 |
135.3 |
-8.0 |
0.746 |
2 |
0 |
0 |
0.114 |
| 10 |
13 |
|
[MPD]A:504 |
6 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
18079 |
127.1 |
-7.8 |
0.676 |
1 |
0 |
0 |
0.106 |
| 11 |
14 |
|
B |
14 |
4 |
18139 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
18079 |
85.6 |
0.7 |
0.741 |
1 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[MPD]A:504 |
5 |
1 |
276 |
◊ |
B |
x-y-1,-y-1,-z+2/3 |
5_445 |
17 |
6 |
18139 |
85.6 |
-5.2 |
0.673 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[CL]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
18139 |
71.0 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.126 |
17 |
|
[CL]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
18079 |
70.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.126 |
| Average: |
70.8 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.126 |
| 14 |
18 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
18139 |
65.7 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.110 |
19 |
|
[CL]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
18079 |
64.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.110 |
| Average: |
65.0 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.110 |
| 15 |
20 |
|
[CL]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
18139 |
60.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.110 |
21 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
18079 |
60.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.110 |
| Average: |
60.5 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.110 |
| 16 |
22 |
|
A |
8 |
4 |
18079 |
◊ |
[MPD]B:505 |
x-y-1,-y-1,-z+2/3 |
5_445 |
3 |
1 |
279 |
57.3 |
-3.5 |
0.620 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[TRS]B:507 |
4 |
1 |
254 |
f |
[MPD]B:504 |
x,y,z |
1_555 |
3 |
1 |
279 |
36.8 |
-1.3 |
0.000 |
1 |
0 |
0 |
0.022 |
| 18 |
24 |
|
[TRS]A:507 |
4 |
1 |
255 |
f |
[MPD]A:505 |
x,y,z |
1_555 |
3 |
1 |
279 |
36.6 |
-1.2 |
0.999 |
1 |
0 |
0 |
0.021 |
| 19 |
25 |
|
[TRS]A:507 |
3 |
1 |
255 |
f |
[MPD]A:506 |
x,y,z |
1_555 |
3 |
1 |
279 |
36.3 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.014 |
| 20 |
26 |
|
[TRS]B:507 |
3 |
1 |
254 |
f |
[MPD]B:506 |
x,y,z |
1_555 |
3 |
1 |
280 |
36.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.015 |
| 21 |
27 |
|
[MPD]B:506 |
3 |
1 |
280 |
f |
[MPD]B:504 |
x,y,z |
1_555 |
3 |
1 |
279 |
28.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.035 |
28 |
|
[MPD]A:506 |
3 |
1 |
279 |
f |
[MPD]A:505 |
x,y,z |
1_555 |
3 |
1 |
279 |
27.7 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
28.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.035 |
| 22 |
29 |
|
B |
4 |
2 |
18139 |
x |
B |
-y,x-y-1,z+1/3 |
2_545 |
4 |
2 |
18139 |
18.8 |
0.2 |
0.699 |
0 |
0 |
0 |
0.000 |
| 23 |
30 |
|
A |
1 |
1 |
18079 |
◊ |
B |
x-y-1,-y-1,-z-1/3 |
5_444 |
1 |
1 |
18139 |
10.8 |
-0.3 |
0.178 |
0 |
0 |
0 |
0.000 |
|