## |
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 |
177 |
42 |
10449 |
◊ |
A |
x,y,z |
1_555 |
181 |
49 |
18767 |
1677.6 |
-8.3 |
0.290 |
30 |
19 |
0 |
0.421 |
2 |
|
F |
173 |
39 |
10470 |
◊ |
E |
x,y,z |
1_555 |
167 |
47 |
18721 |
1630.8 |
-8.1 |
0.256 |
28 |
19 |
0 |
0.421 |
3 |
|
D |
177 |
40 |
10389 |
◊ |
C |
x,y,z |
1_555 |
157 |
47 |
18582 |
1599.7 |
-6.5 |
0.327 |
30 |
19 |
0 |
0.421 |
Average: |
1636.0 |
-7.6 |
0.291 |
29 |
19 |
0 |
0.421 |
2 |
4 |
|
E |
167 |
39 |
18721 |
◊ |
C |
x,y,z |
1_555 |
168 |
46 |
18582 |
1590.7 |
-8.8 |
0.265 |
29 |
11 |
0 |
0.416 |
5 |
|
C |
165 |
39 |
18582 |
◊ |
A |
x,y,z |
1_555 |
171 |
49 |
18767 |
1558.2 |
-10.4 |
0.212 |
27 |
12 |
0 |
0.416 |
6 |
|
E |
167 |
47 |
18721 |
◊ |
A |
x,y,z |
1_555 |
167 |
39 |
18767 |
1545.5 |
-10.8 |
0.217 |
31 |
11 |
0 |
0.416 |
Average: |
1564.8 |
-10.0 |
0.231 |
29 |
11 |
0 |
0.416 |
3 |
7 |
|
F |
107 |
28 |
10470 |
◊ |
B |
x,y,z |
1_555 |
110 |
33 |
10449 |
1042.9 |
-3.3 |
0.421 |
13 |
6 |
0 |
1.000 |
8 |
|
F |
113 |
35 |
10470 |
◊ |
D |
x,y,z |
1_555 |
110 |
29 |
10389 |
1040.6 |
-2.0 |
0.495 |
16 |
8 |
0 |
1.000 |
9 |
|
D |
108 |
34 |
10389 |
◊ |
B |
x,y,z |
1_555 |
111 |
27 |
10449 |
1033.9 |
-3.2 |
0.462 |
12 |
6 |
0 |
1.000 |
Average: |
1039.2 |
-2.8 |
0.460 |
14 |
7 |
0 |
1.000 |
4 |
10 |
|
A |
103 |
36 |
18767 |
◊ |
C |
y-1,x,-z |
4_455 |
103 |
34 |
18582 |
841.8 |
7.9 |
0.949 |
12 |
6 |
0 |
0.000 |
5 |
11 |
|
E |
54 |
20 |
18721 |
◊ |
E |
y-1,x+1,-z |
4_465 |
55 |
20 |
18721 |
417.8 |
1.3 |
0.755 |
5 |
0 |
0 |
0.000 |
6 |
12 |
|
D |
35 |
10 |
10389 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
28 |
10 |
18767 |
289.5 |
0.1 |
0.627 |
4 |
3 |
0 |
0.000 |
7 |
13 |
|
B |
27 |
6 |
10449 |
◊ |
C |
x,y,z |
1_555 |
33 |
11 |
18582 |
239.9 |
0.9 |
0.628 |
2 |
0 |
0 |
0.001 |
14 |
|
F |
27 |
6 |
10470 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
18767 |
239.7 |
1.1 |
0.631 |
3 |
0 |
0 |
0.001 |
15 |
|
D |
28 |
6 |
10389 |
◊ |
E |
x,y,z |
1_555 |
33 |
11 |
18721 |
238.9 |
0.7 |
0.635 |
2 |
0 |
0 |
0.001 |
Average: |
239.5 |
0.9 |
0.632 |
2 |
0 |
0 |
0.001 |
8 |
16 |
|
B |
22 |
8 |
10449 |
◊ |
E |
-y,x-y+1,z+1/3 |
2_565 |
17 |
7 |
18721 |
142.1 |
-0.7 |
0.464 |
1 |
0 |
0 |
0.000 |
9 |
17 |
|
[FES]C:455 |
4 |
1 |
236 |
f |
C |
x,y,z |
1_555 |
18 |
8 |
18582 |
119.3 |
-15.7 |
0.603 |
2 |
0 |
0 |
0.297 |
18 |
|
[FES]A:455 |
4 |
1 |
235 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
18767 |
118.6 |
-15.6 |
0.614 |
3 |
0 |
0 |
0.297 |
19 |
|
[FES]E:455 |
4 |
1 |
236 |
f |
E |
x,y,z |
1_555 |
15 |
8 |
18721 |
117.1 |
-15.4 |
0.613 |
2 |
0 |
0 |
0.297 |
Average: |
118.4 |
-15.6 |
0.610 |
2 |
0 |
0 |
0.297 |
10 |
20 |
|
F |
15 |
7 |
10470 |
◊ |
C |
-y,x-y+1,z+1/3 |
2_565 |
13 |
6 |
18582 |
118.7 |
0.8 |
0.713 |
0 |
0 |
0 |
0.000 |
11 |
21 |
|
D |
10 |
5 |
10389 |
◊ |
C |
-x,-x+y,-z+1/3 |
6_555 |
6 |
4 |
18582 |
71.3 |
0.8 |
0.647 |
0 |
0 |
0 |
0.000 |
12 |
22 |
|
[OXY]E:457 |
2 |
1 |
119 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
18582 |
59.4 |
-1.1 |
0.131 |
1 |
0 |
0 |
0.027 |
13 |
23 |
|
[FE]C:456 |
1 |
1 |
137 |
cf |
C |
x,y,z |
1_555 |
10 |
7 |
18582 |
59.2 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.220 |
24 |
|
[FE]E:456 |
1 |
1 |
137 |
cf |
E |
x,y,z |
1_555 |
11 |
7 |
18721 |
59.0 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.220 |
25 |
|
[FE]A:456 |
1 |
1 |
137 |
cf |
A |
x,y,z |
1_555 |
10 |
7 |
18767 |
57.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.220 |
Average: |
58.7 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.220 |
14 |
26 |
|
[OXY]A:457 |
2 |
1 |
120 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
18767 |
58.8 |
-0.9 |
0.139 |
2 |
0 |
0 |
0.031 |
15 |
27 |
|
[OXY]C:457 |
2 |
1 |
119 |
f |
E |
x,y,z |
1_555 |
16 |
8 |
18721 |
58.6 |
-1.0 |
0.170 |
1 |
0 |
0 |
0.025 |
16 |
28 |
|
D |
4 |
2 |
10389 |
◊ |
D |
-x,-x+y,-z+1/3 |
6_555 |
4 |
2 |
10389 |
49.5 |
1.6 |
0.922 |
2 |
0 |
0 |
0.000 |
17 |
29 |
|
F |
6 |
3 |
10470 |
◊ |
A |
-y,x-y+1,z+1/3 |
2_565 |
5 |
3 |
18767 |
35.4 |
-0.4 |
0.406 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
[OXY]C:457 |
2 |
1 |
119 |
f |
[FE]E:456 |
x,y,z |
1_555 |
1 |
1 |
137 |
32.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.050 |
19 |
31 |
|
[OXY]A:457 |
2 |
1 |
120 |
f |
[FE]A:456 |
x,y,z |
1_555 |
1 |
1 |
137 |
32.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.050 |
32 |
|
[OXY]E:457 |
2 |
1 |
119 |
f |
[FE]C:456 |
x,y,z |
1_555 |
1 |
1 |
137 |
32.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.050 |
Average: |
32.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.050 |
20 |
33 |
|
E |
3 |
1 |
18721 |
◊ |
A |
y-1,x,-z |
4_455 |
3 |
1 |
18767 |
16.0 |
-0.4 |
0.381 |
0 |
0 |
0 |
0.000 |
21 |
34 |
|
[FES]E:455 |
3 |
1 |
236 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
18582 |
15.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.021 |
35 |
|
[FES]A:455 |
3 |
1 |
235 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
18721 |
13.0 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.021 |
36 |
|
[FES]C:455 |
3 |
1 |
236 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
18767 |
12.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.021 |
Average: |
13.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.021 |
22 |
37 |
|
[FE]A:456 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
18582 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
38 |
|
[FE]E:456 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
18767 |
0.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
39 |
|
[FE]C:456 |
1 |
1 |
137 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
18721 |
0.4 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.001 |
Average: |
0.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
|