| ## |
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 |
87 |
23 |
8611 |
x |
B |
-y-1,x-y,z+1/3 |
2_455 |
83 |
26 |
8611 |
822.1 |
-12.4 |
0.143 |
1 |
1 |
0 |
0.000 |
2 |
|
A |
81 |
26 |
8436 |
x |
A |
-y,x-y+1,z+1/3 |
2_565 |
87 |
23 |
8436 |
820.9 |
-12.3 |
0.144 |
1 |
1 |
0 |
0.000 |
| Average: |
821.5 |
-12.4 |
0.143 |
1 |
1 |
0 |
0.000 |
| 2 |
3 |
|
B |
51 |
17 |
8611 |
◊ |
A |
x,y,z |
1_555 |
50 |
17 |
8436 |
411.2 |
-1.3 |
0.865 |
2 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
36 |
10 |
8436 |
◊ |
B |
-y-1,x-y,z+1/3 |
2_455 |
37 |
12 |
8611 |
282.9 |
-1.6 |
0.780 |
1 |
0 |
0 |
0.000 |
5 |
|
A |
35 |
12 |
8436 |
◊ |
B |
-y,x-y+1,z+1/3 |
2_565 |
32 |
10 |
8611 |
253.3 |
-3.0 |
0.593 |
1 |
0 |
0 |
0.000 |
| Average: |
268.1 |
-2.3 |
0.686 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[ACT]A:210 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
8436 |
92.5 |
-0.6 |
0.680 |
1 |
0 |
0 |
0.004 |
| 5 |
7 |
|
[ACT]B:210 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
11 |
8611 |
91.6 |
-0.6 |
0.736 |
1 |
0 |
0 |
0.004 |
| 6 |
8 |
|
[FE]B:208 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
8611 |
50.3 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.032 |
9 |
|
[FE]A:208 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
8436 |
50.0 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
50.2 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.032 |
| 7 |
10 |
|
[FE]A:209 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
8436 |
49.0 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.032 |
11 |
|
[FE]B:209 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
8611 |
48.7 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
48.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.032 |
| 8 |
12 |
|
[ACT]B:210 |
3 |
1 |
184 |
◊ |
B |
-y-1,x-y,z+1/3 |
2_455 |
7 |
3 |
8611 |
41.8 |
-0.6 |
0.612 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
A |
7 |
3 |
8436 |
◊ |
[ACT]A:210 |
-y,x-y+1,z+1/3 |
2_565 |
3 |
1 |
183 |
40.3 |
-0.5 |
0.660 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[ACT]A:210 |
3 |
1 |
183 |
f |
[FE]A:209 |
x,y,z |
1_555 |
1 |
1 |
137 |
25.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.009 |
| 11 |
15 |
|
[FE]B:209 |
1 |
1 |
137 |
f |
[FE]B:208 |
x,y,z |
1_555 |
1 |
1 |
137 |
24.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.018 |
| 12 |
16 |
|
[FE]A:209 |
1 |
1 |
137 |
f |
[FE]A:208 |
x,y,z |
1_555 |
1 |
1 |
137 |
24.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.018 |
| 13 |
17 |
|
[ACT]B:210 |
3 |
1 |
184 |
f |
[FE]B:209 |
x,y,z |
1_555 |
1 |
1 |
137 |
24.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.009 |
| 14 |
18 |
|
[ACT]A:210 |
1 |
1 |
183 |
f |
[FE]A:208 |
x,y,z |
1_555 |
1 |
1 |
137 |
17.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| 15 |
19 |
|
[ACT]B:210 |
2 |
1 |
184 |
f |
[FE]B:208 |
x,y,z |
1_555 |
1 |
1 |
137 |
16.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.005 |
|