| ## |
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 |
100 |
30 |
15640 |
◊ |
A |
x,y,z |
1_555 |
99 |
30 |
16249 |
971.0 |
-6.3 |
0.207 |
15 |
12 |
0 |
0.043 |
2 |
|
D |
102 |
30 |
15499 |
◊ |
C |
x,y,z |
1_555 |
98 |
31 |
16299 |
970.4 |
-6.9 |
0.185 |
16 |
12 |
0 |
0.043 |
| Average: |
970.7 |
-6.6 |
0.196 |
16 |
12 |
0 |
0.043 |
| 2 |
3 |
|
A |
39 |
14 |
16249 |
◊ |
B |
-x-1/2,y-1/2,-z-1 |
4_444 |
59 |
20 |
15640 |
421.3 |
-5.4 |
0.121 |
2 |
1 |
0 |
0.000 |
4 |
|
C |
36 |
12 |
16299 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
56 |
20 |
15499 |
418.1 |
-5.0 |
0.134 |
2 |
1 |
0 |
0.000 |
| Average: |
419.7 |
-5.2 |
0.127 |
2 |
1 |
0 |
0.000 |
| 3 |
5 |
|
C |
31 |
9 |
16299 |
x |
C |
x,y-1,z |
1_545 |
33 |
10 |
16299 |
284.0 |
-0.6 |
0.518 |
4 |
1 |
0 |
0.000 |
6 |
|
A |
33 |
9 |
16249 |
x |
A |
x,y-1,z |
1_545 |
27 |
8 |
16249 |
268.1 |
1.1 |
0.701 |
2 |
1 |
0 |
0.000 |
| Average: |
276.1 |
0.3 |
0.610 |
3 |
1 |
0 |
0.000 |
| 4 |
7 |
|
C |
30 |
12 |
16299 |
◊ |
B |
x,y,z |
1_555 |
29 |
13 |
15640 |
233.0 |
-1.5 |
0.379 |
0 |
1 |
0 |
0.000 |
8 |
|
A |
30 |
13 |
16249 |
◊ |
D |
x,y-1,z |
1_545 |
28 |
12 |
15499 |
222.6 |
-0.8 |
0.448 |
1 |
1 |
0 |
0.000 |
| Average: |
227.8 |
-1.1 |
0.414 |
1 |
1 |
0 |
0.000 |
| 5 |
9 |
|
C |
32 |
7 |
16299 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
32 |
7 |
16249 |
229.8 |
-5.3 |
0.067 |
0 |
0 |
0 |
0.000 |
| 6 |
10 |
|
D |
22 |
9 |
15499 |
◊ |
C |
-x-1/2,y-1/2,-z |
4_445 |
19 |
8 |
16299 |
210.0 |
-1.6 |
0.326 |
2 |
1 |
0 |
0.000 |
11 |
|
B |
17 |
9 |
15640 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
16 |
6 |
16249 |
169.0 |
-1.6 |
0.283 |
1 |
0 |
0 |
0.000 |
| Average: |
189.5 |
-1.6 |
0.304 |
2 |
1 |
0 |
0.000 |
| 7 |
12 |
|
D |
26 |
8 |
15499 |
x |
D |
x,y-1,z |
1_545 |
23 |
7 |
15499 |
202.9 |
2.4 |
0.840 |
1 |
1 |
0 |
0.000 |
13 |
|
B |
20 |
7 |
15640 |
x |
B |
x,y-1,z |
1_545 |
20 |
5 |
15640 |
165.8 |
2.5 |
0.841 |
1 |
0 |
0 |
0.000 |
| Average: |
184.3 |
2.5 |
0.840 |
1 |
1 |
0 |
0.000 |
| 8 |
14 |
|
[PEG]B:397 |
7 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
15640 |
138.0 |
3.3 |
0.356 |
0 |
0 |
0 |
0.000 |
| 9 |
15 |
|
[PEG]A:394 |
7 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
16249 |
137.2 |
4.3 |
0.437 |
1 |
0 |
0 |
0.000 |
| 10 |
16 |
|
C |
14 |
5 |
16299 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
15 |
4 |
15499 |
126.1 |
-2.2 |
0.162 |
0 |
0 |
0 |
0.000 |
| 11 |
17 |
|
B |
15 |
7 |
15640 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
20 |
7 |
16249 |
125.2 |
2.6 |
0.854 |
3 |
5 |
0 |
0.000 |
18 |
|
C |
12 |
8 |
16299 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
16 |
8 |
15499 |
96.1 |
0.8 |
0.716 |
0 |
0 |
0 |
0.000 |
| Average: |
110.6 |
1.7 |
0.785 |
2 |
3 |
0 |
0.000 |
| 12 |
19 |
|
D |
14 |
3 |
15499 |
◊ |
D |
-x,y,-z |
2_555 |
14 |
3 |
15499 |
122.3 |
-2.5 |
0.130 |
2 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[PEG]C:396 |
6 |
1 |
257 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
16299 |
116.6 |
3.7 |
0.463 |
1 |
0 |
0 |
0.000 |
| 14 |
21 |
|
B |
12 |
3 |
15640 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
15 |
4 |
16249 |
114.4 |
-2.1 |
0.182 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[PEG]B:396 |
7 |
1 |
265 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
15640 |
95.5 |
2.8 |
0.310 |
0 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[PEG]C:394 |
6 |
1 |
262 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
16299 |
88.3 |
2.1 |
0.271 |
0 |
0 |
0 |
0.000 |
| 17 |
24 |
|
[PEG]C:395 |
7 |
1 |
261 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
16299 |
84.9 |
2.0 |
0.239 |
0 |
0 |
0 |
0.000 |
| 18 |
25 |
|
B |
11 |
5 |
15640 |
◊ |
C |
x,y-1,z |
1_545 |
9 |
5 |
16299 |
76.6 |
0.6 |
0.689 |
1 |
0 |
0 |
0.000 |
| 19 |
26 |
|
A |
9 |
5 |
16249 |
x |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
11 |
6 |
16249 |
70.7 |
1.8 |
0.851 |
1 |
3 |
0 |
0.000 |
27 |
|
C |
11 |
5 |
16299 |
x |
C |
-x-1/2,y-1/2,-z |
4_445 |
11 |
5 |
16299 |
64.6 |
0.6 |
0.677 |
1 |
3 |
0 |
0.000 |
| Average: |
67.6 |
1.2 |
0.764 |
1 |
3 |
0 |
0.000 |
| 20 |
28 |
|
B |
6 |
2 |
15640 |
◊ |
D |
x,y-1,z |
1_545 |
9 |
3 |
15499 |
65.2 |
1.2 |
0.831 |
0 |
0 |
0 |
0.000 |
29 |
|
D |
5 |
2 |
15499 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
15640 |
58.7 |
0.7 |
0.737 |
0 |
0 |
0 |
0.000 |
| Average: |
61.9 |
1.0 |
0.784 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
B |
9 |
2 |
15640 |
◊ |
B |
-x-1,y,-z-1 |
2_454 |
8 |
2 |
15640 |
63.4 |
-0.4 |
0.454 |
1 |
0 |
0 |
0.000 |
| 22 |
31 |
|
[MG]B:394 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
15640 |
60.9 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.052 |
32 |
|
[MG]D:394 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
14 |
9 |
15499 |
60.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.052 |
| Average: |
60.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.052 |
| 23 |
33 |
|
[MG]C:393 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
16299 |
57.9 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.190 |
34 |
|
[MG]A:393 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
16249 |
57.9 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.190 |
35 |
|
[MG]D:393 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
15499 |
57.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.190 |
36 |
|
[MG]B:393 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
15640 |
57.3 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.190 |
| Average: |
57.7 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.190 |
| 24 |
37 |
|
[PEG]B:396 |
3 |
1 |
265 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16249 |
54.4 |
0.5 |
0.322 |
0 |
0 |
0 |
0.000 |
| 25 |
38 |
|
[PEG]C:394 |
3 |
1 |
262 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
10 |
3 |
16249 |
54.2 |
0.6 |
0.278 |
0 |
0 |
0 |
0.000 |
| 26 |
39 |
|
[MG]B:395 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
15640 |
43.0 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.025 |
| 27 |
40 |
|
[PEG]C:395 |
2 |
1 |
261 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
15499 |
32.4 |
1.1 |
0.510 |
0 |
0 |
0 |
0.000 |
| 28 |
41 |
|
B |
3 |
1 |
15640 |
f |
[PEG]C:394 |
x,y-1,z |
1_545 |
2 |
1 |
262 |
13.4 |
0.3 |
0.383 |
0 |
0 |
0 |
0.000 |
| 29 |
42 |
|
[MG]B:395 |
1 |
1 |
98 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
16249 |
6.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
43 |
|
D |
1 |
1 |
15499 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
16249 |
6.5 |
0.3 |
0.864 |
0 |
0 |
0 |
0.000 |
| 31 |
44 |
|
A |
1 |
1 |
16249 |
◊ |
A |
-x,y,-z-1 |
2_554 |
1 |
1 |
16249 |
1.1 |
0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
|