## |
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 |
|
L |
116 |
27 |
3264 |
◊ |
H |
x,y,z |
1_555 |
144 |
39 |
12214 |
1178.9 |
-9.6 |
0.348 |
25 |
8 |
1 |
0.451 |
2 |
|
B |
104 |
23 |
2906 |
◊ |
A |
x,y,z |
1_555 |
127 |
36 |
11899 |
1047.0 |
-9.4 |
0.359 |
22 |
8 |
1 |
0.451 |
Average: |
1113.0 |
-9.5 |
0.353 |
24 |
8 |
1 |
0.451 |
2 |
3 |
|
H |
56 |
13 |
12214 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
57 |
13 |
11899 |
519.7 |
-5.2 |
0.105 |
3 |
0 |
0 |
0.000 |
3 |
4 |
|
M |
32 |
5 |
741 |
◊ |
H |
x,y,z |
1_555 |
84 |
30 |
12214 |
508.7 |
-1.8 |
0.310 |
7 |
2 |
0 |
0.008 |
4 |
5 |
|
H |
35 |
10 |
12214 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
9 |
11899 |
295.9 |
-0.1 |
0.396 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
28 |
7 |
11899 |
◊ |
L |
x-1,y,z |
1_455 |
24 |
7 |
3264 |
246.5 |
-2.1 |
0.324 |
3 |
0 |
0 |
0.000 |
7 |
|
B |
22 |
7 |
2906 |
◊ |
H |
x-1,y,z |
1_455 |
25 |
7 |
12214 |
240.3 |
-2.4 |
0.302 |
3 |
0 |
0 |
0.000 |
Average: |
243.4 |
-2.2 |
0.313 |
3 |
0 |
0 |
0.000 |
6 |
8 |
|
L |
20 |
8 |
3264 |
◊ |
A |
x,y,z |
1_555 |
29 |
10 |
11899 |
230.2 |
2.1 |
0.781 |
8 |
6 |
0 |
0.017 |
7 |
9 |
|
H |
15 |
3 |
12214 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
3 |
2906 |
136.5 |
2.0 |
0.842 |
1 |
1 |
0 |
0.000 |
8 |
10 |
|
H |
26 |
11 |
12214 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
4 |
11899 |
134.2 |
1.5 |
0.701 |
2 |
2 |
0 |
0.000 |
9 |
11 |
|
[NAG]A:1373 |
10 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
10 |
5 |
11899 |
117.3 |
2.6 |
0.289 |
0 |
0 |
0 |
0.000 |
12 |
|
[NAG]H:1373 |
10 |
1 |
364 |
cf |
H |
x,y,z |
1_555 |
10 |
5 |
12214 |
116.8 |
2.5 |
0.316 |
0 |
0 |
0 |
0.000 |
Average: |
117.1 |
2.5 |
0.303 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
H |
14 |
7 |
12214 |
x |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
4 |
12214 |
99.4 |
-0.4 |
0.414 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[SO4]A:1582 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11899 |
94.8 |
-13.1 |
0.836 |
3 |
0 |
0 |
0.198 |
12 |
15 |
|
[SO4]A:1581 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
11899 |
90.7 |
-14.0 |
0.501 |
2 |
0 |
0 |
0.205 |
13 |
16 |
|
H |
17 |
8 |
12214 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
11899 |
89.5 |
0.2 |
0.561 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
A |
12 |
6 |
11899 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
15 |
3 |
11899 |
89.0 |
1.1 |
0.672 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
[NA]H:1581 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
20 |
11 |
12214 |
83.3 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.202 |
19 |
|
[NA]A:1579 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
19 |
11 |
11899 |
83.2 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.202 |
Average: |
83.3 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.202 |
16 |
20 |
|
B |
10 |
3 |
2906 |
◊ |
L |
x-1,y,z |
1_455 |
9 |
3 |
3264 |
79.2 |
-1.3 |
0.451 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[SO4]A:1580 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
11899 |
79.2 |
-8.7 |
0.933 |
3 |
0 |
0 |
0.138 |
18 |
22 |
|
[SO4]H:1582 |
5 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
11 |
4 |
12214 |
78.2 |
-11.3 |
0.745 |
4 |
0 |
0 |
0.228 |
19 |
23 |
|
[SO4]H:1583 |
5 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
8 |
3 |
12214 |
64.1 |
-7.5 |
0.851 |
4 |
0 |
0 |
0.162 |
20 |
24 |
|
H |
6 |
2 |
12214 |
x |
H |
x-1,y,z |
1_455 |
6 |
2 |
12214 |
48.6 |
0.2 |
0.585 |
1 |
0 |
0 |
0.000 |
21 |
25 |
|
B |
2 |
1 |
2906 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
11899 |
36.4 |
0.5 |
0.428 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[SO4]A:1580 |
4 |
1 |
186 |
◊ |
H |
x,y,z |
1_555 |
4 |
3 |
12214 |
35.7 |
-3.8 |
0.857 |
0 |
0 |
0 |
0.027 |
23 |
27 |
|
[SO4]H:1583 |
1 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
11899 |
17.8 |
-2.0 |
0.735 |
0 |
0 |
0 |
0.015 |
24 |
28 |
|
[SO4]A:1580 |
2 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
3264 |
16.8 |
-2.2 |
0.735 |
0 |
0 |
0 |
0.016 |
25 |
29 |
|
A |
1 |
1 |
11899 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
12214 |
9.6 |
-0.3 |
0.194 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[SO4]A:1581 |
3 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
3264 |
5.0 |
-0.4 |
0.826 |
0 |
0 |
0 |
0.003 |
27 |
31 |
|
L |
1 |
1 |
3264 |
◊ |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
12214 |
0.6 |
0.0 |
0.698 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
M |
1 |
1 |
741 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
11899 |
0.5 |
0.0 |
0.670 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
L |
1 |
1 |
3264 |
◊ |
[SO4]H:1582 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
184 |
0.4 |
-0.0 |
0.846 |
0 |
0 |
0 |
0.000 |
|