| ## |
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 |
|
D |
131 |
37 |
8696 |
◊ |
C |
x,y,z |
1_555 |
137 |
40 |
8584 |
1278.6 |
-10.6 |
0.365 |
13 |
9 |
0 |
0.412 |
2 |
|
B |
131 |
38 |
8577 |
◊ |
A |
x,y,z |
1_555 |
131 |
38 |
8561 |
1242.6 |
-10.4 |
0.419 |
12 |
10 |
0 |
0.412 |
| Average: |
1260.6 |
-10.5 |
0.392 |
13 |
10 |
0 |
0.412 |
| 2 |
3 |
|
D |
60 |
17 |
8696 |
x |
D |
-y+1,x-y+1,z |
2_665 |
75 |
22 |
8696 |
695.6 |
-5.5 |
0.249 |
6 |
5 |
0 |
0.548 |
4 |
|
C |
76 |
23 |
8584 |
x |
B |
x,y,z |
1_555 |
58 |
16 |
8577 |
684.8 |
-5.7 |
0.261 |
5 |
5 |
0 |
0.548 |
5 |
|
A |
60 |
17 |
8561 |
x |
B |
-y+1,x-y+1,z |
2_665 |
78 |
23 |
8577 |
684.7 |
-4.4 |
0.350 |
5 |
5 |
0 |
0.548 |
6 |
|
A |
76 |
22 |
8561 |
x |
C |
-y+1,x-y+1,z |
2_665 |
59 |
16 |
8584 |
675.0 |
-4.0 |
0.362 |
6 |
4 |
0 |
0.548 |
| Average: |
685.0 |
-4.9 |
0.306 |
6 |
5 |
0 |
0.548 |
| 3 |
7 |
|
B |
47 |
14 |
8577 |
x |
B |
-y+1,x-y+1,z |
2_665 |
56 |
15 |
8577 |
483.8 |
-5.1 |
0.284 |
4 |
1 |
0 |
0.198 |
8 |
|
C |
46 |
13 |
8584 |
x |
D |
-y+1,x-y+1,z |
2_665 |
55 |
15 |
8696 |
476.8 |
-4.8 |
0.284 |
4 |
3 |
0 |
0.198 |
9 |
|
C |
50 |
14 |
8584 |
x |
A |
x,y,z |
1_555 |
47 |
13 |
8561 |
471.4 |
-5.6 |
0.252 |
4 |
2 |
0 |
0.198 |
10 |
|
A |
53 |
14 |
8561 |
x |
D |
-y+1,x-y+1,z |
2_665 |
46 |
13 |
8696 |
465.5 |
-5.1 |
0.327 |
5 |
5 |
0 |
0.198 |
| Average: |
474.4 |
-5.2 |
0.287 |
4 |
3 |
0 |
0.198 |
| 4 |
11 |
|
B |
29 |
7 |
8577 |
◊ |
B |
-x+4/3,-x+y+2/3,-z+2/3 |
18_655 |
28 |
7 |
8577 |
245.7 |
1.5 |
0.826 |
2 |
4 |
0 |
0.000 |
12 |
|
A |
26 |
7 |
8561 |
◊ |
A |
-x+4/3,-x+y+2/3,-z+2/3 |
18_655 |
26 |
7 |
8561 |
241.2 |
0.9 |
0.805 |
2 |
2 |
0 |
0.000 |
13 |
|
D |
31 |
7 |
8696 |
◊ |
C |
y,x,-z+1 |
4_556 |
28 |
7 |
8584 |
232.5 |
1.0 |
0.796 |
1 |
3 |
0 |
0.000 |
| Average: |
239.8 |
1.1 |
0.809 |
2 |
3 |
0 |
0.000 |
| 5 |
14 |
|
[FE]D:1162 |
1 |
1 |
137 |
cf |
D |
x,y,z |
1_555 |
7 |
2 |
8696 |
54.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.429 |
15 |
|
[FE]A:1162 |
1 |
1 |
137 |
cf |
A |
x,y,z |
1_555 |
6 |
2 |
8561 |
52.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.429 |
16 |
|
[FE]B:1162 |
1 |
1 |
137 |
cf |
B |
x,y,z |
1_555 |
6 |
2 |
8577 |
52.4 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.429 |
17 |
|
[FE]C:1162 |
1 |
1 |
137 |
cf |
C |
x,y,z |
1_555 |
8 |
2 |
8584 |
52.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.429 |
| Average: |
52.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.429 |
| 6 |
18 |
|
[FE]A:1162 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
8577 |
46.1 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.299 |
19 |
|
[FE]D:1162 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
8584 |
45.3 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.299 |
20 |
|
[FE]B:1162 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
8561 |
45.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.299 |
21 |
|
[FE]C:1162 |
1 |
1 |
137 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
8696 |
44.5 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.299 |
| Average: |
45.3 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.299 |
| 7 |
22 |
|
B |
1 |
1 |
8577 |
◊ |
A |
-x+4/3,-x+y+2/3,-z+2/3 |
18_655 |
1 |
1 |
8561 |
22.4 |
-0.7 |
0.111 |
0 |
0 |
0 |
0.000 |
23 |
|
D |
1 |
1 |
8696 |
◊ |
D |
y,x,-z+1 |
4_556 |
1 |
1 |
8696 |
21.6 |
-0.7 |
0.124 |
0 |
0 |
0 |
0.000 |
24 |
|
C |
1 |
1 |
8584 |
◊ |
C |
y,x,-z+1 |
4_556 |
1 |
1 |
8584 |
20.7 |
-0.7 |
0.126 |
0 |
0 |
0 |
0.000 |
| Average: |
21.6 |
-0.7 |
0.120 |
0 |
0 |
0 |
0.000 |
| 8 |
25 |
|
A |
6 |
3 |
8561 |
◊ |
[FE]C:1162 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
137 |
14.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.050 |
26 |
|
[FE]A:1162 |
1 |
1 |
137 |
◊ |
B |
-y+1,x-y+1,z |
2_665 |
3 |
2 |
8577 |
10.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.050 |
27 |
|
[FE]D:1162 |
1 |
1 |
137 |
◊ |
D |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
8696 |
9.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.050 |
28 |
|
[FE]B:1162 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
8584 |
7.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.050 |
| Average: |
10.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.050 |
|