| ## |
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 |
111 |
29 |
13196 |
◊ |
D |
-x,y,-z+1/2 |
3_555 |
111 |
29 |
13196 |
950.1 |
-5.7 |
0.683 |
8 |
6 |
0 |
0.086 |
2 |
|
A |
103 |
27 |
12875 |
◊ |
C |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
99 |
25 |
12847 |
912.6 |
-9.2 |
0.457 |
4 |
4 |
0 |
0.086 |
3 |
|
B |
99 |
25 |
12956 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
99 |
25 |
12956 |
856.1 |
-7.5 |
0.570 |
8 |
8 |
0 |
0.086 |
| Average: |
906.3 |
-7.5 |
0.570 |
7 |
6 |
0 |
0.086 |
| 2 |
4 |
|
B |
70 |
20 |
12956 |
◊ |
A |
x,y,z |
1_555 |
68 |
20 |
12875 |
709.6 |
-9.8 |
0.219 |
3 |
2 |
0 |
0.045 |
| 3 |
5 |
|
B |
73 |
20 |
12956 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
68 |
18 |
12875 |
590.1 |
-4.6 |
0.590 |
8 |
0 |
0 |
0.249 |
6 |
|
C |
67 |
18 |
12847 |
◊ |
D |
x-1/2,y+1/2,z |
5_455 |
70 |
20 |
13196 |
589.4 |
-5.2 |
0.543 |
8 |
0 |
0 |
0.249 |
| Average: |
589.8 |
-4.9 |
0.567 |
8 |
0 |
0 |
0.249 |
| 4 |
7 |
|
C |
56 |
18 |
12847 |
◊ |
A |
x,y,z |
1_555 |
53 |
18 |
12875 |
542.7 |
-5.7 |
0.407 |
6 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[0N6]C:801 |
30 |
1 |
586 |
f |
C |
x,y,z |
1_555 |
59 |
18 |
12847 |
425.0 |
2.1 |
0.500 |
5 |
0 |
0 |
0.100 |
9 |
|
[0N6]D:801 |
30 |
1 |
583 |
f |
D |
x,y,z |
1_555 |
57 |
19 |
13196 |
391.9 |
1.7 |
0.411 |
4 |
0 |
0 |
0.100 |
10 |
|
[0N6]B:801 |
30 |
1 |
581 |
f |
B |
x,y,z |
1_555 |
54 |
19 |
12956 |
369.1 |
1.7 |
0.416 |
4 |
0 |
0 |
0.100 |
11 |
|
[0N6]A:402 |
30 |
1 |
584 |
f |
A |
x,y,z |
1_555 |
49 |
17 |
12875 |
367.7 |
1.6 |
0.390 |
4 |
0 |
0 |
0.100 |
| Average: |
388.4 |
1.8 |
0.429 |
4 |
0 |
0 |
0.100 |
| 6 |
12 |
|
B |
40 |
14 |
12956 |
◊ |
B |
x,-y,-z |
4_555 |
40 |
14 |
12956 |
395.2 |
-1.6 |
0.691 |
6 |
0 |
0 |
0.000 |
| 7 |
13 |
|
D |
43 |
15 |
13196 |
◊ |
C |
x,-y,-z+1 |
4_556 |
39 |
11 |
12847 |
363.2 |
-5.1 |
0.337 |
1 |
0 |
0 |
0.000 |
| 8 |
14 |
|
D |
30 |
11 |
13196 |
◊ |
C |
x,y,z |
1_555 |
30 |
9 |
12847 |
309.3 |
-2.3 |
0.492 |
2 |
0 |
0 |
0.000 |
| 9 |
15 |
|
D |
31 |
13 |
13196 |
◊ |
D |
x,-y,-z+1 |
4_556 |
31 |
13 |
13196 |
257.0 |
-0.1 |
0.756 |
4 |
0 |
0 |
0.000 |
| 10 |
16 |
|
D |
26 |
9 |
13196 |
◊ |
A |
x,y,z |
1_555 |
26 |
10 |
12875 |
248.4 |
-3.7 |
0.244 |
2 |
1 |
0 |
0.000 |
| 11 |
17 |
|
B |
28 |
10 |
12956 |
◊ |
A |
x,-y,-z |
4_555 |
21 |
6 |
12875 |
216.2 |
-1.5 |
0.545 |
2 |
1 |
0 |
0.000 |
| 12 |
18 |
|
A |
18 |
5 |
12875 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
18 |
5 |
12875 |
149.7 |
-1.0 |
0.595 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[BME]A:403 |
4 |
1 |
203 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
13196 |
97.0 |
-1.1 |
0.361 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
B |
14 |
4 |
12956 |
f |
[SO4]A:404 |
x-1/2,y-1/2,z |
5_445 |
5 |
1 |
186 |
78.9 |
-11.6 |
0.724 |
1 |
0 |
0 |
0.365 |
| 15 |
21 |
|
[BME]A:403 |
4 |
1 |
203 |
cf |
A |
x,y,z |
1_555 |
11 |
6 |
12875 |
76.8 |
-1.2 |
0.300 |
1 |
0 |
0 |
0.089 |
| 16 |
22 |
|
[SO4]A:404 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
12875 |
72.7 |
-10.3 |
0.785 |
1 |
0 |
0 |
0.328 |
| 17 |
23 |
|
B |
6 |
3 |
12956 |
◊ |
C |
-x-1,-y,z-1/2 |
2_454 |
5 |
2 |
12847 |
35.9 |
1.6 |
0.918 |
0 |
1 |
0 |
0.000 |
24 |
|
D |
2 |
1 |
13196 |
◊ |
C |
-x-1/2,y-1/2,-z+1/2 |
7_445 |
2 |
1 |
12847 |
23.9 |
0.9 |
0.902 |
0 |
1 |
0 |
0.000 |
| Average: |
29.9 |
1.3 |
0.910 |
0 |
1 |
0 |
0.000 |
| 18 |
25 |
|
B |
5 |
1 |
12956 |
◊ |
A |
-x-1/2,y-1/2,-z+1/2 |
7_445 |
3 |
1 |
12875 |
31.1 |
-0.3 |
0.512 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
C |
1 |
1 |
12847 |
x |
C |
x-1/2,-y+1/2,-z+1 |
8_456 |
2 |
1 |
12847 |
12.9 |
0.2 |
0.719 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
D |
1 |
1 |
13196 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
12875 |
0.8 |
0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
|