| ## |
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 |
146 |
42 |
12314 |
◊ |
C |
x,y,z |
1_555 |
150 |
41 |
12296 |
1436.3 |
-23.7 |
0.006 |
16 |
0 |
0 |
0.873 |
2 |
|
B |
149 |
41 |
12398 |
◊ |
A |
x,y,z |
1_555 |
154 |
42 |
12425 |
1423.8 |
-24.2 |
0.004 |
15 |
0 |
0 |
0.873 |
| Average: |
1430.1 |
-23.9 |
0.005 |
16 |
0 |
0 |
0.873 |
| 2 |
3 |
|
D |
98 |
26 |
12314 |
◊ |
B |
x,y,z |
1_555 |
100 |
26 |
12398 |
971.4 |
-5.2 |
0.403 |
16 |
6 |
0 |
0.278 |
4 |
|
C |
98 |
26 |
12296 |
◊ |
A |
x,y,z |
1_555 |
95 |
26 |
12425 |
930.8 |
-5.8 |
0.335 |
15 |
5 |
0 |
0.278 |
| Average: |
951.1 |
-5.5 |
0.369 |
16 |
6 |
0 |
0.278 |
| 3 |
5 |
|
D |
37 |
8 |
12314 |
◊ |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
39 |
10 |
12398 |
346.9 |
-0.8 |
0.577 |
4 |
7 |
0 |
0.000 |
| 4 |
6 |
|
C |
32 |
12 |
12296 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
43 |
13 |
12398 |
327.4 |
-2.5 |
0.362 |
4 |
4 |
0 |
0.000 |
| 5 |
7 |
|
D |
35 |
8 |
12314 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
40 |
12 |
12425 |
310.1 |
-1.3 |
0.512 |
5 |
1 |
0 |
0.000 |
| 6 |
8 |
|
C |
42 |
13 |
12296 |
◊ |
A |
x-1,y,z |
1_455 |
34 |
10 |
12425 |
296.4 |
0.1 |
0.653 |
3 |
4 |
0 |
0.000 |
| 7 |
9 |
|
A |
42 |
8 |
12425 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
9 |
12425 |
289.8 |
0.2 |
0.581 |
3 |
5 |
0 |
0.000 |
| 8 |
10 |
|
C |
24 |
8 |
12296 |
◊ |
B |
x-1,y,z |
1_455 |
30 |
13 |
12398 |
230.0 |
1.2 |
0.732 |
2 |
2 |
0 |
0.000 |
| 9 |
11 |
|
[3VN]D:301 |
16 |
1 |
545 |
◊ |
D |
x,y,z |
1_555 |
34 |
14 |
12314 |
228.0 |
-1.7 |
0.773 |
5 |
0 |
0 |
0.112 |
12 |
|
[3VN]A:301 |
16 |
1 |
544 |
◊ |
A |
x,y,z |
1_555 |
33 |
14 |
12425 |
212.4 |
-1.5 |
0.740 |
5 |
0 |
0 |
0.112 |
| Average: |
220.2 |
-1.6 |
0.757 |
5 |
0 |
0 |
0.112 |
| 10 |
13 |
|
[3VN]D:301 |
15 |
1 |
545 |
f |
C |
x,y,z |
1_555 |
33 |
14 |
12296 |
226.7 |
-3.2 |
0.627 |
5 |
0 |
0 |
0.168 |
14 |
|
[3VN]A:301 |
17 |
1 |
544 |
f |
B |
x,y,z |
1_555 |
35 |
14 |
12398 |
214.6 |
-3.3 |
0.629 |
6 |
0 |
0 |
0.168 |
| Average: |
220.7 |
-3.3 |
0.628 |
6 |
0 |
0 |
0.168 |
| 11 |
15 |
|
[PG4]A:302 |
13 |
1 |
405 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
12425 |
197.3 |
5.9 |
0.400 |
1 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[PGE]B:302 |
10 |
1 |
330 |
f |
B |
x,y,z |
1_555 |
26 |
7 |
12398 |
180.2 |
6.3 |
0.452 |
3 |
0 |
0 |
0.000 |
| 13 |
17 |
|
D |
11 |
4 |
12314 |
x |
D |
x-1/2,-y-1/2,-z+1 |
4_446 |
18 |
7 |
12314 |
116.9 |
1.2 |
0.782 |
0 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[EDO]D:303 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
21 |
7 |
12314 |
112.7 |
3.4 |
0.507 |
1 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[EDO]C:301 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
12296 |
103.3 |
3.7 |
0.532 |
4 |
0 |
0 |
0.000 |
| 16 |
20 |
|
A |
16 |
6 |
12425 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
9 |
3 |
12314 |
97.5 |
1.7 |
0.834 |
1 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[EDO]B:304 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
12398 |
94.8 |
2.2 |
0.380 |
2 |
0 |
0 |
0.000 |
| 18 |
22 |
|
C |
18 |
6 |
12296 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
10 |
4 |
12425 |
90.6 |
1.4 |
0.801 |
1 |
2 |
0 |
0.000 |
| 19 |
23 |
|
[EDO]A:305 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
12425 |
88.8 |
2.3 |
0.411 |
1 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[EDO]A:303 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
12425 |
86.3 |
2.0 |
0.257 |
2 |
0 |
0 |
0.000 |
| 21 |
25 |
|
D |
8 |
5 |
12314 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
15 |
6 |
12398 |
83.6 |
2.1 |
0.865 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[EDO]B:303 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
12398 |
79.4 |
1.8 |
0.484 |
1 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[EDO]D:302 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
12314 |
74.0 |
1.7 |
0.248 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
12398 |
73.0 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.341 |
| 25 |
29 |
|
[EDO]A:304 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
12425 |
71.7 |
1.8 |
0.236 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[EDO]C:302 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
12296 |
70.7 |
1.6 |
0.736 |
1 |
0 |
0 |
0.000 |
| 27 |
31 |
|
[EDO]B:305 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
12425 |
67.0 |
1.5 |
0.242 |
1 |
0 |
0 |
0.000 |
| 28 |
32 |
|
[EDO]B:305 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
12398 |
59.5 |
1.1 |
0.706 |
1 |
0 |
0 |
0.000 |
| 29 |
33 |
|
A |
6 |
3 |
12425 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
12398 |
48.1 |
0.6 |
0.779 |
1 |
0 |
0 |
0.000 |
| 30 |
34 |
|
[EDO]B:305 |
3 |
1 |
185 |
f |
[3VN]A:301 |
x,y,z |
1_555 |
4 |
1 |
544 |
36.2 |
0.8 |
0.855 |
0 |
0 |
0 |
0.000 |
| 31 |
35 |
|
[EDO]C:302 |
2 |
1 |
184 |
f |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
2 |
12398 |
30.6 |
0.2 |
0.595 |
0 |
0 |
0 |
0.000 |
| 32 |
36 |
|
A |
4 |
2 |
12425 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
3 |
12296 |
23.3 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
| 33 |
37 |
|
B |
4 |
2 |
12398 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
12398 |
22.2 |
0.4 |
0.764 |
0 |
0 |
0 |
0.000 |
| 34 |
38 |
|
[EDO]D:302 |
1 |
1 |
185 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
12425 |
12.7 |
0.3 |
0.924 |
0 |
0 |
0 |
0.000 |
| 35 |
39 |
|
D |
1 |
1 |
12314 |
◊ |
[EDO]A:305 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
186 |
9.5 |
0.2 |
0.916 |
0 |
0 |
0 |
0.000 |
| 36 |
40 |
|
D |
1 |
1 |
12314 |
◊ |
[EDO]B:303 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
184 |
4.7 |
0.1 |
0.906 |
0 |
0 |
0 |
0.000 |
| 37 |
41 |
|
D |
1 |
1 |
12314 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
12398 |
3.0 |
0.2 |
0.815 |
0 |
0 |
0 |
0.000 |
| 38 |
42 |
|
C |
1 |
1 |
12296 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
12314 |
1.4 |
0.1 |
0.753 |
0 |
0 |
0 |
0.000 |
| 39 |
43 |
|
C |
1 |
1 |
12296 |
f |
[EDO]B:303 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
184 |
1.3 |
-0.0 |
0.704 |
0 |
0 |
0 |
0.000 |
| 40 |
44 |
|
[CL]B:301 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12425 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
| 41 |
45 |
|
[EDO]D:302 |
1 |
1 |
185 |
f |
[EDO]A:305 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
186 |
0.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
[EDO]A:304 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
12398 |
0.3 |
0.0 |
0.819 |
0 |
0 |
0 |
0.000 |
|