| ## |
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 |
|
D |
182 |
44 |
12300 |
◊ |
B |
x,y,z |
1_555 |
184 |
46 |
12323 |
1811.8 |
-34.7 |
0.010 |
7 |
0 |
0 |
0.569 |
2 |
|
C |
175 |
45 |
12115 |
◊ |
A |
x,y,z |
1_555 |
178 |
47 |
12464 |
1805.1 |
-33.0 |
0.013 |
11 |
0 |
0 |
0.569 |
| Average: |
1808.5 |
-33.8 |
0.011 |
9 |
0 |
0 |
0.569 |
| 2 |
3 |
|
D |
152 |
39 |
12300 |
◊ |
C |
x,y,z |
1_555 |
155 |
39 |
12115 |
1366.8 |
-22.8 |
0.098 |
11 |
0 |
0 |
0.514 |
4 |
|
B |
155 |
39 |
12323 |
◊ |
A |
x,y,z |
1_555 |
152 |
40 |
12464 |
1361.8 |
-22.4 |
0.101 |
11 |
0 |
0 |
0.514 |
| Average: |
1364.3 |
-22.6 |
0.100 |
11 |
0 |
0 |
0.514 |
| 3 |
5 |
|
[NAP]D:1269 |
45 |
1 |
886 |
f |
D |
x,y,z |
1_555 |
87 |
33 |
12300 |
583.4 |
-0.9 |
0.753 |
15 |
0 |
0 |
0.272 |
6 |
|
[NAP]A:1269 |
44 |
1 |
880 |
f |
A |
x,y,z |
1_555 |
87 |
33 |
12464 |
583.4 |
-1.0 |
0.721 |
16 |
0 |
0 |
0.272 |
7 |
|
[NAP]C:1269 |
45 |
1 |
879 |
f |
C |
x,y,z |
1_555 |
83 |
33 |
12115 |
580.2 |
-0.9 |
0.740 |
14 |
0 |
0 |
0.272 |
8 |
|
[NAP]B:1269 |
45 |
1 |
880 |
f |
B |
x,y,z |
1_555 |
88 |
33 |
12323 |
579.8 |
-0.8 |
0.724 |
16 |
0 |
0 |
0.272 |
| Average: |
581.7 |
-0.9 |
0.734 |
15 |
0 |
0 |
0.272 |
| 4 |
9 |
|
D |
64 |
16 |
12300 |
◊ |
A |
x,y,z |
1_555 |
60 |
15 |
12464 |
542.9 |
-5.5 |
0.492 |
3 |
0 |
0 |
0.065 |
10 |
|
C |
61 |
15 |
12115 |
◊ |
B |
x,y,z |
1_555 |
62 |
16 |
12323 |
542.4 |
-5.3 |
0.489 |
2 |
0 |
0 |
0.065 |
| Average: |
542.6 |
-5.4 |
0.490 |
3 |
0 |
0 |
0.065 |
| 5 |
11 |
|
B |
45 |
14 |
12323 |
◊ |
C |
x-1,y,z-1 |
1_454 |
51 |
18 |
12115 |
410.7 |
-3.1 |
0.594 |
3 |
0 |
0 |
0.000 |
| 6 |
12 |
|
A |
47 |
18 |
12464 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
44 |
14 |
12323 |
385.8 |
-0.3 |
0.805 |
6 |
5 |
0 |
0.000 |
| 7 |
13 |
|
D |
34 |
13 |
12300 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
33 |
10 |
12115 |
273.0 |
1.1 |
0.872 |
4 |
0 |
0 |
0.000 |
| 8 |
14 |
|
D |
27 |
8 |
12300 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
7 |
12464 |
243.3 |
-2.9 |
0.430 |
2 |
0 |
0 |
0.000 |
| 9 |
15 |
|
[KP2]B:1270 |
17 |
1 |
390 |
f |
B |
x,y,z |
1_555 |
40 |
15 |
12323 |
220.8 |
2.1 |
0.356 |
4 |
0 |
0 |
0.000 |
16 |
|
[KP2]C:1270 |
17 |
1 |
387 |
f |
C |
x,y,z |
1_555 |
40 |
15 |
12115 |
219.2 |
2.0 |
0.342 |
4 |
0 |
0 |
0.000 |
17 |
|
[KP2]D:1270 |
17 |
1 |
392 |
f |
D |
x,y,z |
1_555 |
39 |
15 |
12300 |
219.1 |
2.0 |
0.362 |
4 |
0 |
0 |
0.000 |
18 |
|
[KP2]A:1270 |
17 |
1 |
388 |
f |
A |
x,y,z |
1_555 |
39 |
15 |
12464 |
212.8 |
1.8 |
0.341 |
3 |
0 |
0 |
0.000 |
| Average: |
218.0 |
2.0 |
0.350 |
4 |
0 |
0 |
0.000 |
| 10 |
19 |
|
[DTU]A:1168 |
8 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
12464 |
170.7 |
-3.7 |
0.325 |
2 |
0 |
0 |
0.158 |
20 |
|
[DTU]B:1168 |
8 |
1 |
287 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
12323 |
155.3 |
-4.2 |
0.317 |
1 |
0 |
0 |
0.158 |
| Average: |
163.0 |
-4.0 |
0.321 |
2 |
0 |
0 |
0.158 |
| 11 |
21 |
|
[DTU]D:1168 |
8 |
1 |
294 |
f |
D |
x,y,z |
1_555 |
19 |
9 |
12300 |
163.7 |
-4.0 |
0.297 |
1 |
0 |
0 |
0.083 |
| 12 |
22 |
|
[DTU]C:1168 |
8 |
1 |
299 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
12115 |
156.3 |
-2.6 |
0.415 |
2 |
0 |
0 |
0.066 |
| 13 |
23 |
|
[KP2]D:1270 |
14 |
1 |
392 |
f |
[NAP]D:1269 |
x,y,z |
1_555 |
15 |
1 |
886 |
114.0 |
-1.2 |
0.069 |
4 |
0 |
0 |
0.112 |
24 |
|
[KP2]C:1270 |
14 |
1 |
387 |
f |
[NAP]C:1269 |
x,y,z |
1_555 |
17 |
1 |
879 |
111.9 |
-1.3 |
0.061 |
4 |
0 |
0 |
0.112 |
25 |
|
[KP2]B:1270 |
14 |
1 |
390 |
f |
[NAP]B:1269 |
x,y,z |
1_555 |
15 |
1 |
880 |
111.9 |
-1.3 |
0.060 |
4 |
0 |
0 |
0.112 |
26 |
|
[KP2]A:1270 |
14 |
1 |
388 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
16 |
1 |
880 |
110.7 |
-1.3 |
0.061 |
4 |
0 |
0 |
0.112 |
| Average: |
112.1 |
-1.3 |
0.063 |
4 |
0 |
0 |
0.112 |
| 14 |
27 |
|
B |
12 |
3 |
12323 |
◊ |
D |
x,y,z-1 |
1_554 |
9 |
4 |
12300 |
101.5 |
0.4 |
0.767 |
3 |
0 |
0 |
0.000 |
| 15 |
28 |
|
D |
14 |
4 |
12300 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
7 |
2 |
12300 |
81.2 |
-0.4 |
0.623 |
1 |
0 |
0 |
0.000 |
| 16 |
29 |
|
[ACT]A:1271 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
12464 |
76.5 |
-0.7 |
0.631 |
1 |
0 |
0 |
0.019 |
| 17 |
30 |
|
[ACT]A:1271 |
4 |
1 |
182 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
13 |
7 |
12323 |
71.6 |
-0.5 |
0.688 |
1 |
0 |
0 |
0.000 |
| 18 |
31 |
|
A |
6 |
3 |
12464 |
◊ |
C |
x,y,z-1 |
1_554 |
8 |
4 |
12115 |
64.1 |
0.5 |
0.777 |
1 |
1 |
0 |
0.000 |
| 19 |
32 |
|
[KP2]A:1270 |
7 |
1 |
388 |
f |
[DTU]A:1168 |
x,y,z |
1_555 |
4 |
1 |
296 |
49.2 |
0.9 |
0.376 |
0 |
0 |
0 |
0.009 |
33 |
|
[KP2]B:1270 |
7 |
1 |
390 |
f |
[DTU]B:1168 |
x,y,z |
1_555 |
3 |
1 |
287 |
34.8 |
-0.6 |
0.266 |
0 |
0 |
0 |
0.009 |
| Average: |
42.0 |
0.2 |
0.321 |
0 |
0 |
0 |
0.009 |
| 20 |
34 |
|
[KP2]D:1270 |
7 |
1 |
392 |
f |
[DTU]D:1168 |
x,y,z |
1_555 |
4 |
1 |
294 |
38.4 |
2.1 |
0.371 |
0 |
0 |
0 |
0.000 |
| 21 |
35 |
|
[KP2]C:1270 |
7 |
1 |
387 |
f |
[DTU]C:1168 |
x,y,z |
1_555 |
3 |
1 |
299 |
33.5 |
-0.0 |
0.253 |
0 |
0 |
0 |
0.000 |
| 22 |
36 |
|
[DTU]D:1168 |
2 |
1 |
294 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12464 |
24.6 |
-0.7 |
0.604 |
0 |
0 |
0 |
0.003 |
| 23 |
37 |
|
[DTU]B:1168 |
3 |
1 |
287 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
12115 |
23.7 |
-0.2 |
0.708 |
0 |
0 |
0 |
0.000 |
38 |
|
[DTU]A:1168 |
3 |
1 |
296 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12300 |
15.0 |
0.5 |
0.715 |
0 |
0 |
0 |
0.000 |
| Average: |
19.3 |
0.1 |
0.711 |
0 |
0 |
0 |
0.000 |
| 24 |
39 |
|
[DTU]C:1168 |
3 |
1 |
299 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12323 |
18.7 |
0.8 |
0.713 |
0 |
0 |
0 |
0.000 |
| 25 |
40 |
|
D |
3 |
3 |
12300 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
12115 |
9.4 |
-0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
41 |
|
B |
1 |
1 |
12323 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
12464 |
3.6 |
0.1 |
0.804 |
0 |
0 |
0 |
0.000 |
| Average: |
6.5 |
0.1 |
0.706 |
0 |
0 |
0 |
0.000 |
|