## |
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 |
135 |
34 |
14556 |
◊ |
A |
x,y,z |
1_555 |
129 |
34 |
14431 |
1178.5 |
-11.1 |
0.290 |
21 |
0 |
0 |
0.087 |
2 |
2 |
|
A |
64 |
18 |
14431 |
x |
A |
-y,x-y+1,z+1/3 |
2_565 |
75 |
21 |
14431 |
630.7 |
-1.3 |
0.585 |
7 |
2 |
0 |
0.000 |
3 |
3 |
|
A |
40 |
13 |
14431 |
◊ |
B |
y-1,x,-z+1 |
4_456 |
39 |
14 |
14556 |
391.1 |
-4.0 |
0.312 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
[GSH]A:401 |
20 |
1 |
519 |
f |
A |
x,y,z |
1_555 |
57 |
21 |
14431 |
335.4 |
-5.9 |
0.566 |
10 |
0 |
0 |
0.084 |
5 |
|
[GSH]B:401 |
19 |
1 |
510 |
f |
B |
x,y,z |
1_555 |
52 |
20 |
14556 |
320.1 |
-5.4 |
0.569 |
9 |
0 |
0 |
0.084 |
Average: |
327.7 |
-5.7 |
0.568 |
10 |
0 |
0 |
0.084 |
5 |
6 |
|
B |
33 |
10 |
14556 |
◊ |
B |
-x,-x+y,-z+1/3 |
6_555 |
33 |
10 |
14556 |
321.5 |
-4.4 |
0.228 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
25 |
8 |
14556 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
28 |
7 |
14431 |
205.8 |
-3.1 |
0.304 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[MES]A:410 |
11 |
1 |
327 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
14431 |
173.7 |
2.6 |
0.119 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
B |
20 |
6 |
14556 |
◊ |
B |
-x,-x+y,-z+4/3 |
6_556 |
20 |
6 |
14556 |
166.0 |
-2.3 |
0.334 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
[SO4]A:405 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14431 |
97.7 |
-14.4 |
0.856 |
2 |
0 |
0 |
0.065 |
10 |
11 |
|
[SO4]A:406 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14431 |
95.5 |
-13.8 |
0.507 |
1 |
0 |
0 |
0.061 |
11 |
12 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
14556 |
91.4 |
-12.4 |
0.658 |
2 |
0 |
0 |
0.057 |
12 |
13 |
|
[SO4]A:403 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
14431 |
89.8 |
-11.9 |
0.729 |
2 |
0 |
0 |
0.055 |
13 |
14 |
|
[SO4]B:406 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
14556 |
84.8 |
-12.8 |
0.428 |
1 |
0 |
0 |
0.056 |
14 |
15 |
|
[SO4]A:409 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14431 |
81.0 |
-11.9 |
0.789 |
4 |
0 |
0 |
0.058 |
15 |
16 |
|
[SO4]A:404 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
14431 |
79.9 |
-11.2 |
0.748 |
0 |
0 |
0 |
0.048 |
16 |
17 |
|
[SO4]B:407 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
14556 |
79.5 |
-10.8 |
0.747 |
0 |
0 |
0 |
0.046 |
17 |
18 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
14556 |
77.2 |
-11.5 |
0.752 |
2 |
0 |
0 |
0.053 |
18 |
19 |
|
[SO4]A:402 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
14431 |
72.0 |
-9.6 |
0.898 |
4 |
0 |
0 |
0.048 |
19 |
20 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
14556 |
71.0 |
-8.8 |
0.932 |
2 |
0 |
0 |
0.041 |
20 |
21 |
|
[SO4]A:408 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
14431 |
60.1 |
-6.7 |
0.934 |
1 |
0 |
0 |
0.031 |
21 |
22 |
|
[SO4]A:407 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
14431 |
57.8 |
-7.7 |
0.745 |
2 |
0 |
0 |
0.037 |
22 |
23 |
|
[SO4]B:406 |
4 |
1 |
185 |
f |
[GSH]B:401 |
x,y,z |
1_555 |
8 |
1 |
510 |
57.6 |
-8.5 |
0.804 |
2 |
0 |
0 |
0.040 |
23 |
24 |
|
[SO4]A:406 |
4 |
1 |
185 |
f |
[GSH]A:401 |
x,y,z |
1_555 |
9 |
1 |
519 |
54.0 |
-8.0 |
0.835 |
1 |
0 |
0 |
0.036 |
24 |
25 |
|
[SO4]B:404 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
14556 |
50.9 |
-6.7 |
0.728 |
1 |
0 |
0 |
0.030 |
25 |
26 |
|
[SO4]A:408 |
4 |
1 |
186 |
f |
[SO4]A:405 |
x,y,z |
1_555 |
4 |
1 |
185 |
33.9 |
-7.5 |
0.998 |
0 |
0 |
0 |
0.032 |
26 |
27 |
|
[MES]A:410 |
4 |
1 |
327 |
f |
[GSH]A:401 |
x,y,z |
1_555 |
3 |
1 |
519 |
29.6 |
0.5 |
0.089 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
B |
4 |
1 |
14556 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
3 |
1 |
14431 |
19.4 |
-0.2 |
0.462 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
[SO4]A:404 |
1 |
1 |
185 |
f |
[SO4]A:403 |
x,y,z |
1_555 |
2 |
1 |
185 |
18.5 |
-4.5 |
0.876 |
0 |
0 |
0 |
0.019 |
29 |
30 |
|
[SO4]B:407 |
1 |
1 |
185 |
f |
[SO4]B:403 |
x,y,z |
1_555 |
3 |
1 |
185 |
17.8 |
-4.2 |
0.891 |
0 |
0 |
0 |
0.018 |
30 |
31 |
|
[SO4]A:403 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14556 |
13.6 |
-1.9 |
0.538 |
0 |
0 |
0 |
0.008 |
31 |
32 |
|
[SO4]B:403 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
14431 |
8.7 |
-1.2 |
0.634 |
0 |
0 |
0 |
0.005 |
|