## |
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 |
76 |
19 |
8074 |
◊ |
A |
x,y,z |
1_555 |
76 |
20 |
8180 |
766.0 |
-17.3 |
0.015 |
3 |
1 |
0 |
0.333 |
2 |
|
D |
76 |
21 |
8050 |
◊ |
B |
x,y,z |
1_555 |
76 |
19 |
8123 |
752.6 |
-17.1 |
0.017 |
3 |
1 |
0 |
0.333 |
Average: |
759.3 |
-17.2 |
0.016 |
3 |
1 |
0 |
0.333 |
2 |
3 |
|
B |
48 |
16 |
8123 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
45 |
13 |
8074 |
420.1 |
-6.1 |
0.328 |
1 |
2 |
0 |
0.000 |
3 |
4 |
|
B |
44 |
15 |
8123 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
8180 |
396.5 |
-2.9 |
0.587 |
2 |
0 |
0 |
0.000 |
5 |
|
B |
40 |
11 |
8123 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
44 |
16 |
8180 |
386.2 |
-2.6 |
0.593 |
3 |
1 |
0 |
0.000 |
Average: |
391.3 |
-2.8 |
0.590 |
3 |
1 |
0 |
0.000 |
4 |
6 |
|
[BB2]A:202 |
25 |
1 |
591 |
f |
A |
x,y,z |
1_555 |
53 |
20 |
8180 |
369.4 |
1.5 |
0.555 |
8 |
0 |
0 |
0.087 |
7 |
|
[BB2]D:202 |
24 |
1 |
590 |
f |
D |
x,y,z |
1_555 |
50 |
19 |
8050 |
366.5 |
1.8 |
0.588 |
8 |
0 |
0 |
0.087 |
8 |
|
[BB2]B:202 |
25 |
1 |
596 |
f |
B |
x,y,z |
1_555 |
53 |
19 |
8123 |
366.2 |
1.1 |
0.562 |
7 |
0 |
0 |
0.087 |
9 |
|
[BB2]C:202 |
23 |
1 |
591 |
f |
C |
x,y,z |
1_555 |
51 |
18 |
8074 |
366.1 |
0.3 |
0.519 |
7 |
0 |
0 |
0.087 |
Average: |
367.1 |
1.1 |
0.556 |
8 |
0 |
0 |
0.087 |
5 |
10 |
|
C |
32 |
11 |
8074 |
◊ |
B |
x,y,z |
1_555 |
31 |
11 |
8123 |
295.1 |
0.0 |
0.809 |
2 |
2 |
0 |
0.000 |
11 |
|
D |
31 |
10 |
8050 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
32 |
11 |
8180 |
292.3 |
-0.4 |
0.747 |
3 |
2 |
0 |
0.000 |
Average: |
293.7 |
-0.2 |
0.778 |
3 |
2 |
0 |
0.000 |
6 |
12 |
|
A |
26 |
9 |
8180 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
27 |
10 |
8050 |
271.4 |
-5.2 |
0.151 |
0 |
0 |
0 |
0.000 |
7 |
13 |
|
[FE2]A:201 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8180 |
53.4 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.352 |
14 |
|
[FE2]B:201 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
8123 |
53.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.352 |
15 |
|
[FE2]D:201 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
8050 |
53.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.352 |
16 |
|
[FE2]C:201 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
8074 |
52.8 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.352 |
Average: |
53.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.352 |
8 |
17 |
|
[BB2]D:202 |
6 |
1 |
590 |
f |
[FE2]D:201 |
x,y,z |
1_555 |
1 |
1 |
137 |
42.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.148 |
18 |
|
[BB2]B:202 |
6 |
1 |
596 |
f |
[FE2]B:201 |
x,y,z |
1_555 |
1 |
1 |
137 |
42.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.148 |
19 |
|
[BB2]A:202 |
7 |
1 |
591 |
f |
[FE2]A:201 |
x,y,z |
1_555 |
1 |
1 |
137 |
41.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.148 |
20 |
|
[BB2]C:202 |
6 |
1 |
591 |
f |
[FE2]C:201 |
x,y,z |
1_555 |
1 |
1 |
137 |
41.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.148 |
Average: |
42.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.148 |
9 |
21 |
|
D |
5 |
3 |
8050 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
8074 |
40.8 |
1.1 |
0.901 |
1 |
2 |
0 |
0.000 |
22 |
|
D |
3 |
1 |
8050 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
3 |
8074 |
26.1 |
0.3 |
0.784 |
0 |
0 |
0 |
0.000 |
Average: |
33.5 |
0.7 |
0.842 |
1 |
1 |
0 |
0.000 |
10 |
23 |
|
[MG]B:203 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
8123 |
40.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.082 |
24 |
|
[MG]A:203 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
8180 |
39.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.082 |
Average: |
39.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.082 |
11 |
25 |
|
D |
5 |
4 |
8050 |
◊ |
[MG]A:203 |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
36.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
|
[MG]B:203 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
8074 |
35.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
36.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.000 |
12 |
27 |
|
[MG]B:204 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
8123 |
35.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.068 |
13 |
28 |
|
[MG]B:204 |
1 |
1 |
98 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
3 |
8180 |
30.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|