| ## |
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 |
248 |
69 |
15826 |
◊ |
A |
x,y,z |
1_555 |
256 |
71 |
16745 |
2391.6 |
-21.6 |
0.324 |
43 |
9 |
0 |
0.813 |
2 |
|
C |
246 |
69 |
16158 |
◊ |
B |
x,y,z |
1_555 |
247 |
69 |
16330 |
2374.4 |
-18.4 |
0.394 |
44 |
10 |
0 |
0.813 |
| Average: |
2383.0 |
-20.0 |
0.359 |
44 |
10 |
0 |
0.813 |
| 2 |
3 |
|
B |
78 |
22 |
16330 |
◊ |
A |
x,y,z |
1_555 |
78 |
21 |
16745 |
840.2 |
-10.7 |
0.172 |
9 |
0 |
0 |
0.512 |
| 3 |
4 |
|
B |
61 |
18 |
16330 |
◊ |
A |
x,y,z-1 |
1_554 |
61 |
18 |
16745 |
599.2 |
-8.3 |
0.187 |
10 |
0 |
0 |
0.171 |
5 |
|
C |
63 |
17 |
16158 |
◊ |
D |
x,y,z-1 |
1_554 |
60 |
18 |
15826 |
591.2 |
-8.6 |
0.146 |
10 |
0 |
0 |
0.171 |
| Average: |
595.2 |
-8.5 |
0.167 |
10 |
0 |
0 |
0.171 |
| 4 |
6 |
|
[COA]C:1003 |
41 |
1 |
987 |
◊ |
C |
x,y,z |
1_555 |
68 |
26 |
16158 |
543.7 |
4.1 |
0.626 |
8 |
0 |
0 |
0.000 |
7 |
|
[COA]D:1004 |
38 |
1 |
988 |
◊ |
D |
x,y,z |
1_555 |
63 |
25 |
15826 |
533.1 |
3.7 |
0.554 |
7 |
0 |
0 |
0.000 |
8 |
|
[COA]B:1002 |
41 |
1 |
987 |
◊ |
B |
x,y,z |
1_555 |
66 |
24 |
16330 |
522.0 |
4.1 |
0.628 |
7 |
0 |
0 |
0.000 |
9 |
|
[COA]A:1001 |
42 |
1 |
982 |
◊ |
A |
x,y,z |
1_555 |
63 |
24 |
16745 |
520.3 |
4.1 |
0.624 |
3 |
0 |
0 |
0.000 |
| Average: |
529.8 |
4.0 |
0.608 |
6 |
0 |
0 |
0.000 |
| 5 |
10 |
|
B |
36 |
11 |
16330 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
41 |
13 |
16158 |
367.8 |
-3.6 |
0.390 |
1 |
0 |
0 |
0.000 |
| 6 |
11 |
|
B |
30 |
10 |
16330 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
34 |
14 |
16158 |
327.4 |
-4.2 |
0.280 |
0 |
0 |
0 |
0.000 |
| 7 |
12 |
|
B |
32 |
11 |
16330 |
◊ |
D |
x,y,z-1 |
1_554 |
30 |
10 |
15826 |
293.6 |
-3.5 |
0.308 |
6 |
0 |
0 |
0.080 |
13 |
|
C |
27 |
10 |
16158 |
◊ |
A |
x,y,z-1 |
1_554 |
30 |
11 |
16745 |
259.0 |
-2.8 |
0.357 |
7 |
0 |
0 |
0.080 |
| Average: |
276.3 |
-3.1 |
0.332 |
7 |
0 |
0 |
0.080 |
| 8 |
14 |
|
C |
29 |
7 |
16158 |
◊ |
A |
x,y,z |
1_555 |
28 |
13 |
16745 |
255.1 |
0.1 |
0.702 |
3 |
0 |
0 |
0.026 |
15 |
|
D |
17 |
5 |
15826 |
◊ |
B |
x,y,z |
1_555 |
17 |
8 |
16330 |
120.1 |
-1.8 |
0.398 |
1 |
0 |
0 |
0.026 |
| Average: |
187.6 |
-0.9 |
0.550 |
2 |
0 |
0 |
0.026 |
| 9 |
16 |
|
B |
25 |
7 |
16330 |
x |
B |
x-1,y,z |
1_455 |
19 |
6 |
16330 |
188.4 |
0.8 |
0.707 |
3 |
0 |
0 |
0.000 |
17 |
|
D |
20 |
6 |
15826 |
x |
D |
x-1,y,z |
1_455 |
23 |
8 |
15826 |
172.2 |
0.2 |
0.707 |
1 |
1 |
0 |
0.000 |
| Average: |
180.3 |
0.5 |
0.707 |
2 |
1 |
0 |
0.000 |
| 10 |
18 |
|
D |
13 |
5 |
15826 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
8 |
4 |
16745 |
98.5 |
-0.4 |
0.584 |
2 |
1 |
0 |
0.000 |
| 11 |
19 |
|
C |
11 |
3 |
16158 |
◊ |
B |
x-1,y,z |
1_455 |
11 |
5 |
16330 |
84.5 |
1.2 |
0.826 |
1 |
0 |
0 |
0.000 |
20 |
|
D |
7 |
5 |
15826 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
16745 |
44.2 |
0.5 |
0.758 |
0 |
0 |
0 |
0.000 |
| Average: |
64.4 |
0.8 |
0.792 |
1 |
0 |
0 |
0.000 |
| 12 |
21 |
|
[CL]B:2001 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
16330 |
53.1 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.487 |
22 |
|
[CL]B:2002 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
16158 |
52.8 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.487 |
23 |
|
[CL]A:2003 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
16745 |
52.6 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.487 |
| Average: |
52.9 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.487 |
| 13 |
24 |
|
[CL]B:2001 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
16158 |
48.1 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.190 |
25 |
|
[CL]A:2003 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
15826 |
47.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.190 |
26 |
|
[CL]B:2002 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
16330 |
46.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.190 |
| Average: |
47.3 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.190 |
| 14 |
27 |
|
C |
4 |
1 |
16158 |
◊ |
A |
x-1,y,z-1 |
1_454 |
3 |
1 |
16745 |
38.9 |
-0.2 |
0.521 |
0 |
0 |
0 |
0.000 |
| 15 |
28 |
|
D |
6 |
3 |
15826 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
3 |
16745 |
37.3 |
0.7 |
0.746 |
0 |
0 |
0 |
0.000 |
| 16 |
29 |
|
[COA]C:1003 |
4 |
1 |
987 |
◊ |
D |
x,y,z-1 |
1_554 |
4 |
1 |
15826 |
28.0 |
0.6 |
0.568 |
0 |
0 |
0 |
0.000 |
30 |
|
[COA]B:1002 |
5 |
1 |
987 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
1 |
16745 |
27.6 |
0.3 |
0.527 |
0 |
0 |
0 |
0.000 |
31 |
|
B |
3 |
1 |
16330 |
◊ |
[COA]A:1001 |
x,y,z-1 |
1_554 |
5 |
1 |
982 |
22.5 |
0.5 |
0.563 |
0 |
0 |
0 |
0.000 |
32 |
|
C |
3 |
1 |
16158 |
◊ |
[COA]D:1004 |
x,y,z-1 |
1_554 |
3 |
1 |
988 |
21.4 |
0.4 |
0.574 |
0 |
0 |
0 |
0.000 |
| Average: |
24.9 |
0.5 |
0.558 |
0 |
0 |
0 |
0.000 |
| 17 |
33 |
|
D |
3 |
1 |
15826 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
16158 |
9.8 |
0.2 |
0.699 |
0 |
0 |
0 |
0.000 |
| 18 |
34 |
|
A |
1 |
1 |
16745 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
16745 |
6.7 |
0.3 |
0.867 |
0 |
0 |
0 |
0.000 |
35 |
|
C |
2 |
1 |
16158 |
x |
C |
x-1,y,z |
1_455 |
2 |
1 |
16158 |
4.2 |
0.2 |
0.746 |
0 |
0 |
0 |
0.000 |
| Average: |
5.5 |
0.2 |
0.807 |
0 |
0 |
0 |
0.000 |
| 19 |
36 |
|
[COA]B:1002 |
2 |
1 |
987 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
16158 |
5.3 |
0.2 |
0.588 |
0 |
0 |
0 |
0.001 |
37 |
|
[COA]D:1004 |
1 |
1 |
988 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
16745 |
0.8 |
-0.0 |
0.563 |
0 |
0 |
0 |
0.001 |
38 |
|
[COA]C:1003 |
1 |
1 |
987 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
16330 |
0.5 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.001 |
| Average: |
2.2 |
0.0 |
0.567 |
0 |
0 |
0 |
0.001 |
|