| ## |
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 |
139 |
47 |
15340 |
◊ |
A |
x,y,z |
1_555 |
130 |
34 |
9082 |
1388.8 |
1.1 |
0.648 |
27 |
20 |
0 |
0.434 |
2 |
|
D |
135 |
44 |
15709 |
◊ |
C |
x,y,z |
1_555 |
127 |
30 |
8791 |
1335.1 |
-1.1 |
0.491 |
29 |
19 |
0 |
0.434 |
| Average: |
1362.0 |
-0.0 |
0.570 |
28 |
20 |
0 |
0.434 |
| 2 |
3 |
|
D |
62 |
19 |
15709 |
◊ |
B |
x,y,z |
1_555 |
80 |
24 |
15340 |
655.8 |
-8.8 |
0.063 |
4 |
1 |
0 |
0.111 |
| 3 |
4 |
|
B |
54 |
14 |
15340 |
◊ |
C |
x,y,z |
1_555 |
55 |
18 |
8791 |
503.5 |
-2.6 |
0.342 |
8 |
1 |
0 |
0.066 |
| 4 |
5 |
|
D |
48 |
19 |
15709 |
x |
D |
x-1,y,z |
1_455 |
36 |
10 |
15709 |
458.6 |
0.5 |
0.502 |
6 |
3 |
0 |
0.000 |
| 5 |
6 |
|
B |
33 |
11 |
15340 |
◊ |
A |
x-1,y,z |
1_455 |
43 |
10 |
9082 |
363.9 |
-5.5 |
0.109 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
C |
36 |
10 |
8791 |
◊ |
D |
x,y-1,z |
1_545 |
31 |
10 |
15709 |
313.4 |
-1.1 |
0.444 |
1 |
0 |
0 |
0.000 |
8 |
|
A |
37 |
10 |
9082 |
◊ |
B |
x,y-1,z |
1_545 |
35 |
10 |
15340 |
307.5 |
-0.5 |
0.524 |
1 |
0 |
0 |
0.000 |
| Average: |
310.4 |
-0.8 |
0.484 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
26 |
11 |
15340 |
◊ |
D |
x,y,z-1 |
1_554 |
30 |
12 |
15709 |
253.5 |
-0.3 |
0.511 |
4 |
3 |
0 |
0.000 |
| 8 |
10 |
|
B |
25 |
10 |
15340 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
22 |
9 |
15709 |
224.9 |
1.9 |
0.638 |
2 |
0 |
0 |
0.000 |
| 9 |
11 |
|
B |
40 |
14 |
15340 |
◊ |
D |
x-1,y,z |
1_455 |
27 |
6 |
15709 |
223.1 |
0.7 |
0.607 |
3 |
0 |
0 |
0.000 |
| 10 |
12 |
|
B |
26 |
8 |
15340 |
x |
B |
x-1,y,z |
1_455 |
18 |
6 |
15340 |
182.1 |
0.7 |
0.625 |
3 |
0 |
0 |
0.000 |
| 11 |
13 |
|
A |
19 |
7 |
9082 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
17 |
9 |
15709 |
168.6 |
-0.4 |
0.506 |
2 |
3 |
0 |
0.000 |
| 12 |
14 |
|
B |
17 |
5 |
15340 |
◊ |
C |
x-1,y,z-1 |
1_454 |
15 |
6 |
8791 |
125.1 |
-1.0 |
0.399 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
A |
12 |
4 |
9082 |
◊ |
D |
x,y-1,z-1 |
1_544 |
14 |
5 |
15709 |
117.0 |
0.0 |
0.516 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[SO4]A:1250 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
9082 |
101.8 |
-16.2 |
0.741 |
10 |
0 |
0 |
0.538 |
17 |
|
[SO4]C:2250 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
8791 |
97.6 |
-15.6 |
0.702 |
8 |
0 |
0 |
0.538 |
| Average: |
99.7 |
-15.9 |
0.721 |
9 |
0 |
0 |
0.538 |
| 15 |
18 |
|
B |
10 |
6 |
15340 |
◊ |
C |
x,y,z-1 |
1_554 |
8 |
3 |
8791 |
82.1 |
1.6 |
0.821 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
D |
4 |
2 |
15709 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
3 |
8791 |
34.8 |
0.6 |
0.750 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[SO4]A:1250 |
2 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
15340 |
28.7 |
-3.8 |
0.767 |
0 |
0 |
0 |
0.100 |
| 18 |
21 |
|
[SO4]C:2250 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
15340 |
26.6 |
-2.1 |
0.954 |
1 |
0 |
0 |
0.026 |
| 19 |
22 |
|
[SO4]C:2250 |
2 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
15709 |
22.3 |
-2.8 |
0.788 |
0 |
0 |
0 |
0.072 |
| 20 |
23 |
|
B |
1 |
1 |
15340 |
◊ |
D |
x-1,y,z-1 |
1_454 |
3 |
1 |
15709 |
13.7 |
-0.1 |
0.311 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
A |
1 |
1 |
9082 |
◊ |
D |
x-1,y-1,z |
1_445 |
1 |
1 |
15709 |
0.1 |
0.0 |
0.651 |
0 |
0 |
0 |
0.000 |
|