## |
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 |
382 |
96 |
13894 |
◊ |
C |
x,y,z |
1_555 |
350 |
81 |
11742 |
3569.7 |
-28.0 |
0.254 |
57 |
20 |
0 |
0.793 |
2 |
|
B |
375 |
94 |
13751 |
◊ |
A |
x,y,z |
1_555 |
356 |
83 |
11723 |
3523.6 |
-27.7 |
0.278 |
56 |
19 |
0 |
0.793 |
3 |
|
F |
375 |
94 |
13822 |
◊ |
E |
x,y,z |
1_555 |
350 |
81 |
11633 |
3509.6 |
-28.4 |
0.226 |
58 |
19 |
0 |
0.793 |
Average: |
3534.3 |
-28.0 |
0.253 |
57 |
19 |
0 |
0.793 |
2 |
4 |
|
B |
167 |
44 |
13751 |
◊ |
B |
-x,-y,z |
2_555 |
169 |
44 |
13751 |
1640.5 |
-30.5 |
0.021 |
6 |
0 |
0 |
0.583 |
5 |
|
F |
164 |
43 |
13822 |
◊ |
F |
-x,y,-z |
3_555 |
165 |
43 |
13822 |
1637.0 |
-30.8 |
0.013 |
8 |
0 |
0 |
0.583 |
6 |
|
D |
164 |
43 |
13894 |
◊ |
D |
x,-y,-z |
4_555 |
164 |
43 |
13894 |
1629.7 |
-31.1 |
0.012 |
6 |
0 |
0 |
0.583 |
Average: |
1635.7 |
-30.8 |
0.015 |
7 |
0 |
0 |
0.583 |
3 |
7 |
|
F |
41 |
14 |
13822 |
◊ |
B |
-x,y,-z |
3_555 |
33 |
8 |
13751 |
354.7 |
-2.3 |
0.440 |
7 |
0 |
0 |
0.130 |
8 |
|
D |
36 |
10 |
13894 |
◊ |
B |
-x,-y,z |
2_555 |
40 |
14 |
13751 |
353.1 |
-2.0 |
0.492 |
7 |
0 |
0 |
0.130 |
9 |
|
F |
34 |
9 |
13822 |
◊ |
D |
x,-y,-z |
4_555 |
41 |
14 |
13894 |
348.4 |
-2.2 |
0.473 |
6 |
0 |
0 |
0.130 |
Average: |
352.0 |
-2.2 |
0.468 |
7 |
0 |
0 |
0.130 |
4 |
10 |
|
F |
33 |
11 |
13822 |
◊ |
D |
x,y,z |
1_555 |
31 |
10 |
13894 |
321.3 |
-2.1 |
0.547 |
5 |
1 |
0 |
0.116 |
11 |
|
F |
28 |
9 |
13822 |
◊ |
B |
x,y,z |
1_555 |
33 |
11 |
13751 |
315.9 |
-2.3 |
0.526 |
5 |
1 |
0 |
0.116 |
12 |
|
D |
32 |
11 |
13894 |
◊ |
B |
x,y,z |
1_555 |
30 |
9 |
13751 |
313.0 |
-2.8 |
0.479 |
4 |
0 |
0 |
0.116 |
Average: |
316.7 |
-2.4 |
0.517 |
5 |
1 |
0 |
0.116 |
5 |
13 |
|
C |
30 |
11 |
11742 |
◊ |
A |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
35 |
13 |
11723 |
293.5 |
1.0 |
0.735 |
6 |
1 |
0 |
0.000 |
6 |
14 |
|
A |
26 |
9 |
11723 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
27 |
9 |
11742 |
224.7 |
1.5 |
0.793 |
4 |
0 |
0 |
0.000 |
7 |
15 |
|
F |
25 |
7 |
13822 |
◊ |
A |
-x,y,-z |
3_555 |
20 |
4 |
11723 |
218.0 |
-2.6 |
0.216 |
3 |
2 |
0 |
0.042 |
16 |
|
B |
26 |
7 |
13751 |
◊ |
C |
-x,-y,z |
2_555 |
18 |
3 |
11742 |
216.3 |
-2.8 |
0.182 |
3 |
2 |
0 |
0.042 |
17 |
|
D |
25 |
7 |
13894 |
◊ |
E |
x,-y,-z |
4_555 |
19 |
4 |
11633 |
212.7 |
-2.9 |
0.174 |
3 |
2 |
0 |
0.042 |
Average: |
215.7 |
-2.8 |
0.191 |
3 |
2 |
0 |
0.042 |
8 |
18 |
|
F |
14 |
7 |
13822 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
11723 |
162.2 |
-2.3 |
0.304 |
0 |
0 |
0 |
0.022 |
19 |
|
B |
15 |
7 |
13751 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
11742 |
159.8 |
-2.4 |
0.294 |
0 |
0 |
0 |
0.022 |
20 |
|
D |
16 |
7 |
13894 |
◊ |
E |
x,y,z |
1_555 |
17 |
5 |
11633 |
149.0 |
-2.3 |
0.301 |
0 |
0 |
0 |
0.022 |
Average: |
157.0 |
-2.3 |
0.300 |
0 |
0 |
0 |
0.022 |
9 |
21 |
|
C |
13 |
4 |
11742 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
11723 |
153.8 |
1.5 |
0.824 |
4 |
3 |
0 |
0.005 |
22 |
|
E |
16 |
6 |
11633 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
11723 |
150.0 |
1.2 |
0.794 |
2 |
4 |
0 |
0.005 |
23 |
|
E |
15 |
4 |
11633 |
◊ |
C |
x,y,z |
1_555 |
16 |
7 |
11742 |
136.4 |
1.0 |
0.763 |
2 |
4 |
0 |
0.005 |
Average: |
146.7 |
1.2 |
0.794 |
3 |
4 |
0 |
0.005 |
10 |
24 |
|
A |
15 |
3 |
11723 |
◊ |
D |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
13 |
4 |
13894 |
109.8 |
0.4 |
0.703 |
0 |
0 |
0 |
0.000 |
11 |
25 |
|
[BME]F:601 |
4 |
1 |
208 |
f |
F |
x,y,z |
1_555 |
14 |
7 |
13822 |
92.4 |
-1.1 |
0.421 |
2 |
0 |
0 |
0.072 |
26 |
|
[BME]B:602 |
4 |
1 |
207 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13751 |
90.1 |
-1.3 |
0.405 |
2 |
0 |
0 |
0.072 |
Average: |
91.2 |
-1.2 |
0.413 |
2 |
0 |
0 |
0.072 |
12 |
27 |
|
[BME]B:602 |
4 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
11723 |
82.8 |
0.3 |
0.554 |
0 |
0 |
0 |
0.004 |
28 |
|
[BME]F:601 |
4 |
1 |
208 |
◊ |
E |
x,y,z |
1_555 |
11 |
5 |
11633 |
80.3 |
-0.3 |
0.357 |
0 |
0 |
0 |
0.004 |
Average: |
81.5 |
-0.0 |
0.455 |
0 |
0 |
0 |
0.004 |
13 |
29 |
|
[BCT]A:301 |
3 |
1 |
162 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
11723 |
65.5 |
0.3 |
0.292 |
4 |
0 |
0 |
0.100 |
14 |
30 |
|
[FE]B:601 |
1 |
1 |
137 |
cf |
B |
x,y,z |
1_555 |
6 |
4 |
13751 |
64.2 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.417 |
31 |
|
[FE]D:600 |
1 |
1 |
137 |
cf |
D |
x,y,z |
1_555 |
6 |
4 |
13894 |
64.2 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.417 |
32 |
|
[FE]F:602 |
1 |
1 |
137 |
cf |
F |
x,y,z |
1_555 |
6 |
4 |
13822 |
63.6 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.417 |
Average: |
64.0 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.417 |
15 |
33 |
|
C |
7 |
3 |
11742 |
◊ |
B |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
3 |
2 |
13751 |
47.1 |
-0.6 |
0.348 |
0 |
0 |
0 |
0.000 |
16 |
34 |
|
E |
6 |
3 |
11633 |
◊ |
A |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
4 |
1 |
11723 |
43.5 |
0.3 |
0.701 |
0 |
0 |
0 |
0.000 |
17 |
35 |
|
D |
3 |
1 |
13894 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
11723 |
39.8 |
1.0 |
0.889 |
2 |
0 |
0 |
0.000 |
36 |
|
B |
3 |
1 |
13751 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
11633 |
39.4 |
0.9 |
0.885 |
2 |
0 |
0 |
0.000 |
37 |
|
F |
3 |
1 |
13822 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
11742 |
39.1 |
0.9 |
0.884 |
2 |
0 |
0 |
0.000 |
Average: |
39.4 |
0.9 |
0.886 |
2 |
0 |
0 |
0.000 |
18 |
38 |
|
[FE]B:601 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
11723 |
22.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.037 |
39 |
|
[FE]D:600 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
11742 |
22.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.037 |
40 |
|
[FE]F:602 |
1 |
1 |
137 |
◊ |
E |
x,y,z |
1_555 |
6 |
4 |
11633 |
21.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.037 |
Average: |
22.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.037 |
19 |
41 |
|
C |
2 |
1 |
11742 |
◊ |
C |
-x-1,-y,z |
2_455 |
2 |
1 |
11742 |
10.0 |
-0.3 |
0.368 |
0 |
0 |
0 |
0.000 |
|