## |
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 |
|
C |
50 |
11 |
18080 |
x |
C |
x-1,y+1,z |
1_465 |
57 |
16 |
18080 |
471.7 |
-1.4 |
0.450 |
1 |
1 |
0 |
0.000 |
2 |
2 |
|
A |
48 |
16 |
17447 |
◊ |
C |
x,y,z-1 |
1_554 |
48 |
14 |
18080 |
432.1 |
-0.9 |
0.568 |
0 |
2 |
0 |
0.000 |
3 |
3 |
|
C |
43 |
13 |
18080 |
◊ |
A |
x-1,y+1,z |
1_465 |
37 |
11 |
17447 |
356.7 |
0.9 |
0.728 |
1 |
0 |
0 |
0.000 |
4 |
4 |
|
C |
36 |
10 |
18080 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
17447 |
323.8 |
2.0 |
0.798 |
4 |
7 |
0 |
0.000 |
5 |
5 |
|
C |
23 |
8 |
18080 |
x |
C |
x,y-1,z |
1_545 |
25 |
8 |
18080 |
214.0 |
-1.6 |
0.383 |
0 |
2 |
0 |
0.000 |
6 |
6 |
|
A |
22 |
10 |
17447 |
x |
A |
x-1,y,z |
1_455 |
25 |
9 |
17447 |
213.1 |
2.2 |
0.783 |
0 |
4 |
0 |
0.000 |
7 |
7 |
|
[SF4]C:502 |
8 |
1 |
298 |
f |
C |
x,y,z |
1_555 |
29 |
16 |
18080 |
191.1 |
-18.3 |
0.366 |
0 |
0 |
0 |
0.030 |
8 |
8 |
|
[SF4]A:501 |
8 |
1 |
300 |
f |
A |
x,y,z |
1_555 |
24 |
13 |
17447 |
184.7 |
-20.9 |
0.356 |
0 |
0 |
0 |
0.030 |
9 |
9 |
|
[SF4]A:502 |
8 |
1 |
298 |
f |
A |
x,y,z |
1_555 |
33 |
18 |
17447 |
182.0 |
-17.9 |
0.325 |
0 |
0 |
0 |
0.026 |
10 |
10 |
|
[SF4]C:501 |
8 |
1 |
303 |
f |
C |
x,y,z |
1_555 |
25 |
12 |
18080 |
178.0 |
-20.9 |
0.371 |
0 |
0 |
0 |
0.034 |
11 |
11 |
|
C |
19 |
8 |
18080 |
◊ |
A |
x-1,y,z+1 |
1_456 |
18 |
8 |
17447 |
166.7 |
-0.7 |
0.504 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
C |
15 |
5 |
18080 |
x |
C |
x-1,y,z |
1_455 |
14 |
5 |
18080 |
120.4 |
1.5 |
0.771 |
1 |
1 |
0 |
0.000 |
13 |
13 |
|
[H2S]C:504 |
1 |
1 |
133 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
18080 |
71.2 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.004 |
14 |
|
[H2S]A:506 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
17447 |
52.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.004 |
Average: |
62.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.004 |
14 |
15 |
|
[NA]A:507 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
17447 |
70.6 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.010 |
15 |
16 |
|
[FE]A:504 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17447 |
55.7 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.013 |
16 |
17 |
|
C |
12 |
3 |
18080 |
f |
[NA]C:505 |
x-1,y+1,z |
1_465 |
1 |
1 |
125 |
55.6 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.012 |
17 |
18 |
|
C |
8 |
3 |
18080 |
f |
[NA]C:506 |
x-1,y+1,z |
1_465 |
1 |
1 |
125 |
53.8 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.010 |
18 |
19 |
|
[H2S]C:504 |
1 |
1 |
133 |
f |
[SF4]C:502 |
x,y,z |
1_555 |
4 |
1 |
298 |
45.5 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.009 |
19 |
20 |
|
[NA]C:506 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
18080 |
45.5 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[NA]C:505 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
8 |
5 |
18080 |
43.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
C |
4 |
1 |
18080 |
◊ |
A |
x-1,y+1,z+1 |
1_466 |
5 |
3 |
17447 |
39.6 |
-0.8 |
0.286 |
0 |
0 |
0 |
0.000 |
22 |
23 |
|
[H2S]A:506 |
1 |
1 |
133 |
f |
[SF4]A:502 |
x,y,z |
1_555 |
4 |
1 |
298 |
34.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.006 |
23 |
24 |
|
[H2S]A:506 |
1 |
1 |
133 |
f |
[FE]A:504 |
x,y,z |
1_555 |
1 |
1 |
137 |
27.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.005 |
24 |
25 |
|
[FE]A:504 |
1 |
1 |
137 |
f |
[SF4]A:502 |
x,y,z |
1_555 |
4 |
1 |
298 |
23.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.006 |
25 |
26 |
|
A |
1 |
1 |
17447 |
x |
A |
x-1,y+1,z |
1_465 |
1 |
1 |
17447 |
0.4 |
0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
|