## |
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 |
121 |
37 |
17824 |
◊ |
A |
x,y,z |
1_555 |
122 |
37 |
18588 |
1308.9 |
-15.7 |
0.152 |
16 |
11 |
0 |
0.187 |
2 |
2 |
|
B |
120 |
38 |
17824 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
119 |
38 |
17824 |
1093.9 |
-16.4 |
0.114 |
6 |
0 |
0 |
0.154 |
3 |
|
A |
119 |
39 |
18588 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
119 |
39 |
18588 |
1062.6 |
-15.9 |
0.144 |
6 |
0 |
0 |
0.154 |
Average: |
1078.3 |
-16.1 |
0.129 |
6 |
0 |
0 |
0.154 |
3 |
4 |
|
A |
62 |
17 |
18588 |
◊ |
A |
x,-y,-z |
4_555 |
62 |
17 |
18588 |
572.3 |
-2.5 |
0.681 |
14 |
8 |
0 |
0.000 |
4 |
5 |
|
A |
41 |
16 |
18588 |
◊ |
B |
x-1/2,-y+1/2,-z |
8_455 |
37 |
9 |
17824 |
345.0 |
1.3 |
0.867 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
[AVJ]A:502 |
13 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
18588 |
239.6 |
-3.5 |
0.419 |
0 |
0 |
0 |
0.058 |
7 |
|
[AVJ]B:502 |
13 |
1 |
371 |
f |
B |
x,y,z |
1_555 |
49 |
19 |
17824 |
237.5 |
-3.6 |
0.405 |
0 |
0 |
0 |
0.058 |
Average: |
238.6 |
-3.5 |
0.412 |
0 |
0 |
0 |
0.058 |
6 |
8 |
|
B |
14 |
4 |
17824 |
x |
B |
x-1/2,-y+1/2,-z |
8_455 |
19 |
8 |
17824 |
140.3 |
-1.1 |
0.486 |
0 |
1 |
0 |
0.000 |
7 |
9 |
|
[IMD]B:506 |
5 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
17824 |
114.8 |
4.0 |
0.484 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
[IMD]A:506 |
5 |
1 |
196 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
18588 |
111.4 |
3.8 |
0.460 |
2 |
0 |
0 |
0.000 |
9 |
11 |
|
[FE]B:505 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
17824 |
64.1 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.159 |
12 |
|
[FE]A:505 |
1 |
1 |
137 |
cf |
A |
x,y,z |
1_555 |
8 |
5 |
18588 |
56.1 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.159 |
Average: |
60.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.159 |
10 |
13 |
|
B |
6 |
2 |
17824 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
7 |
3 |
18588 |
53.9 |
-0.2 |
0.620 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
17824 |
49.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.107 |
15 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
18588 |
48.8 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.107 |
Average: |
49.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.107 |
12 |
16 |
|
[FE]B:501 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
17824 |
45.4 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.120 |
17 |
|
[FE]A:501 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
18588 |
45.3 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.120 |
Average: |
45.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.120 |
13 |
18 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
18588 |
41.3 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.114 |
19 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
17824 |
40.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.114 |
Average: |
41.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.114 |
14 |
20 |
|
[IMD]B:506 |
3 |
1 |
198 |
f |
[FE]B:505 |
x,y,z |
1_555 |
1 |
1 |
137 |
39.3 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.051 |
21 |
|
[IMD]A:506 |
3 |
1 |
196 |
f |
[FE]A:505 |
x,y,z |
1_555 |
1 |
1 |
137 |
37.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.051 |
Average: |
38.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.051 |
15 |
22 |
|
A |
7 |
2 |
18588 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
17824 |
37.9 |
1.2 |
0.882 |
1 |
1 |
0 |
0.000 |
16 |
23 |
|
[AVJ]B:502 |
3 |
1 |
371 |
f |
[FE]B:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
31.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.042 |
24 |
|
[AVJ]A:502 |
3 |
1 |
370 |
f |
[FE]A:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
31.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.042 |
Average: |
31.3 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.042 |
17 |
25 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
[AVJ]B:502 |
x,y,z |
1_555 |
6 |
1 |
371 |
26.1 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
26 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
[AVJ]A:502 |
x,y,z |
1_555 |
5 |
1 |
370 |
25.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.040 |
Average: |
26.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
18 |
27 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
[AVJ]A:502 |
x,y,z |
1_555 |
2 |
1 |
370 |
24.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.036 |
28 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
[AVJ]B:502 |
x,y,z |
1_555 |
2 |
1 |
371 |
24.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.036 |
Average: |
24.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.036 |
19 |
29 |
|
A |
2 |
1 |
18588 |
x |
A |
-x,-y,z-1/2 |
2_554 |
3 |
1 |
18588 |
23.1 |
0.5 |
0.869 |
1 |
1 |
0 |
0.000 |
20 |
30 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
[FE]A:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
22.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.073 |
21 |
31 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
[FE]B:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
22.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.071 |
22 |
32 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
[FE]B:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
21.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.070 |
23 |
33 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
[FE]A:501 |
x,y,z |
1_555 |
1 |
1 |
137 |
21.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.069 |
24 |
34 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
[CL]A:503 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.047 |
25 |
35 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
[CL]B:503 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.045 |
|