| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
180 |
42 |
12024 |
◊ |
A |
x,y,z |
1_555 |
196 |
52 |
18035 |
1765.4 |
-7.0 |
0.498 |
29 |
21 |
0 |
0.265 |
2 |
|
B |
168 |
41 |
12024 |
x |
B |
-y+1,x-y+1,z |
2_665 |
146 |
39 |
12024 |
1502.5 |
-16.3 |
0.110 |
15 |
4 |
0 |
0.538 |
3 |
|
A |
144 |
35 |
18035 |
x |
A |
-y+1,x-y+1,z |
2_665 |
143 |
42 |
18035 |
1394.5 |
-11.4 |
0.247 |
23 |
6 |
0 |
0.334 |
4 |
|
A |
58 |
20 |
18035 |
◊ |
A |
x-y+1/3,-y+2/3,-z+2/3 |
17_555 |
58 |
20 |
18035 |
582.6 |
-11.9 |
0.015 |
0 |
0 |
0 |
0.006 |
5 |
|
A |
24 |
9 |
18035 |
◊ |
A |
y,x,-z+1 |
4_556 |
23 |
9 |
18035 |
227.4 |
-1.9 |
0.403 |
2 |
0 |
0 |
0.000 |
6 |
|
B |
23 |
7 |
12024 |
◊ |
B |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
23 |
7 |
12024 |
193.7 |
-1.3 |
0.480 |
4 |
0 |
0 |
0.000 |
7 |
|
B |
23 |
7 |
12024 |
◊ |
B |
-x+2/3,-x+y+1/3,-z+1/3 |
12_555 |
22 |
7 |
12024 |
171.9 |
0.8 |
0.732 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
17 |
8 |
18035 |
◊ |
B |
-y+1,x-y+1,z |
2_665 |
26 |
6 |
12024 |
164.6 |
-1.1 |
0.431 |
1 |
0 |
0 |
0.012 |
9 |
|
[FES]A:1453 |
4 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
18035 |
121.0 |
-16.0 |
0.648 |
3 |
0 |
0 |
0.258 |
10 |
|
[EDO]B:1695 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
25 |
8 |
12024 |
120.8 |
3.8 |
0.644 |
4 |
0 |
0 |
0.000 |
11 |
|
[SO4]B:1698 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
12024 |
114.5 |
-16.3 |
0.758 |
3 |
0 |
0 |
0.403 |
12 |
|
B |
18 |
8 |
12024 |
◊ |
[EDO]B:1699 |
-y+1,x-y+1,z |
2_665 |
4 |
1 |
182 |
112.8 |
4.1 |
0.491 |
4 |
0 |
0 |
0.000 |
13 |
|
[SO4]A:1452 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
18035 |
94.1 |
-13.5 |
0.882 |
5 |
0 |
0 |
0.233 |
14 |
|
[EDO]A:1450 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
18035 |
90.2 |
2.3 |
0.396 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:1448 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
18035 |
89.4 |
2.9 |
0.675 |
5 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:1696 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
12024 |
77.9 |
1.9 |
0.195 |
2 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:1449 |
4 |
1 |
185 |
f |
A |
-y+1,x-y+1,z |
2_665 |
11 |
6 |
18035 |
75.6 |
1.8 |
0.228 |
1 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:1449 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
18035 |
72.9 |
2.0 |
0.258 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
6 |
3 |
12024 |
◊ |
A |
-x+4/3,-x+y+2/3,-z+2/3 |
18_655 |
6 |
2 |
18035 |
62.5 |
0.9 |
0.820 |
1 |
2 |
0 |
0.000 |
20 |
|
[OXY]A:1451 |
2 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
18035 |
62.0 |
-0.8 |
0.223 |
2 |
0 |
0 |
0.025 |
21 |
|
B |
6 |
2 |
12024 |
◊ |
A |
x-y+1/3,-y+2/3,-z+2/3 |
17_555 |
8 |
3 |
18035 |
61.0 |
-1.2 |
0.269 |
0 |
0 |
0 |
0.001 |
22 |
|
[FE]A:1454 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
18035 |
57.6 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.166 |
23 |
|
[EDO]A:1450 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
12024 |
55.0 |
1.4 |
0.872 |
0 |
0 |
0 |
0.000 |
24 |
|
B |
6 |
3 |
12024 |
◊ |
A |
y-2/3,x-1/3,-z+2/3 |
16_445 |
6 |
2 |
18035 |
55.0 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]B:1696 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
18035 |
52.8 |
1.1 |
0.678 |
1 |
0 |
0 |
0.000 |
26 |
|
[SO4]B:1697 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
12024 |
51.7 |
-6.0 |
0.903 |
2 |
0 |
0 |
0.158 |
27 |
|
[EDO]A:1448 |
4 |
1 |
185 |
f |
A |
-y+1,x-y+1,z |
2_665 |
8 |
2 |
18035 |
51.0 |
0.4 |
0.586 |
1 |
0 |
0 |
0.000 |
28 |
|
[FE]A:1454 |
1 |
1 |
137 |
f |
[OXY]A:1451 |
x,y,z |
1_555 |
2 |
1 |
125 |
34.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.044 |
29 |
|
[EDO]B:1699 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
12024 |
17.0 |
0.6 |
0.968 |
0 |
0 |
0 |
0.000 |
30 |
|
[FES]A:1453 |
2 |
1 |
236 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
18035 |
5.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
31 |
|
[EDO]B:1695 |
1 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
18035 |
2.6 |
-0.0 |
0.615 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
1 |
1 |
18035 |
◊ |
[FE]A:1454 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
137 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|