## |
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 |
440 |
40 |
8015 |
◊ |
A |
x,y,z |
1_555 |
436 |
125 |
60387 |
3947.0 |
-59.0 |
0.800 |
77 |
0 |
0 |
0.863 |
2 |
|
F |
435 |
40 |
8042 |
◊ |
E |
x,y,z |
1_555 |
443 |
124 |
60338 |
3893.3 |
-58.2 |
0.849 |
82 |
0 |
0 |
0.863 |
Average: |
3920.1 |
-58.6 |
0.824 |
80 |
0 |
0 |
0.863 |
2 |
3 |
|
G |
247 |
27 |
6635 |
◊ |
E |
x,y,z |
1_555 |
260 |
88 |
60338 |
2247.4 |
-21.8 |
0.662 |
35 |
0 |
0 |
1.000 |
4 |
|
C |
242 |
27 |
6638 |
◊ |
A |
x,y,z |
1_555 |
261 |
85 |
60387 |
2214.3 |
-20.8 |
0.563 |
39 |
0 |
0 |
1.000 |
Average: |
2230.8 |
-21.3 |
0.613 |
37 |
0 |
0 |
1.000 |
3 |
5 |
|
E |
134 |
42 |
60338 |
◊ |
A |
x,y,z |
1_555 |
131 |
43 |
60387 |
1186.7 |
-0.1 |
0.730 |
13 |
2 |
0 |
0.002 |
4 |
6 |
|
E |
109 |
35 |
60338 |
x |
E |
x-1/2,-y-1/2,-z |
4_445 |
125 |
46 |
60338 |
1041.0 |
-2.3 |
0.638 |
11 |
6 |
0 |
0.000 |
5 |
7 |
|
B |
101 |
20 |
8015 |
◊ |
C |
x,y,z |
1_555 |
103 |
20 |
6638 |
944.9 |
-11.4 |
0.848 |
46 |
0 |
0 |
0.620 |
8 |
|
F |
101 |
20 |
8042 |
◊ |
G |
x,y,z |
1_555 |
101 |
20 |
6635 |
943.5 |
-11.1 |
0.850 |
47 |
0 |
0 |
0.620 |
Average: |
944.2 |
-11.2 |
0.849 |
47 |
0 |
0 |
0.620 |
6 |
9 |
|
A |
119 |
37 |
60387 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
106 |
36 |
60387 |
943.0 |
-4.0 |
0.478 |
9 |
2 |
0 |
0.000 |
7 |
10 |
|
D |
64 |
7 |
2107 |
◊ |
A |
x,y,z |
1_555 |
59 |
23 |
60387 |
547.7 |
-8.5 |
0.417 |
11 |
0 |
0 |
1.000 |
11 |
|
H |
61 |
6 |
2105 |
◊ |
E |
x,y,z |
1_555 |
58 |
21 |
60338 |
520.8 |
-8.3 |
0.405 |
8 |
0 |
0 |
1.000 |
Average: |
534.2 |
-8.4 |
0.411 |
10 |
0 |
0 |
1.000 |
8 |
12 |
|
D |
44 |
9 |
2107 |
◊ |
C |
x,y,z |
1_555 |
38 |
9 |
6638 |
408.3 |
-7.0 |
0.496 |
31 |
0 |
0 |
1.000 |
13 |
|
H |
44 |
9 |
2105 |
◊ |
G |
x,y,z |
1_555 |
36 |
10 |
6635 |
401.4 |
-7.4 |
0.477 |
30 |
0 |
0 |
1.000 |
Average: |
404.8 |
-7.2 |
0.486 |
31 |
0 |
0 |
1.000 |
9 |
14 |
|
E |
43 |
16 |
60338 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
45 |
13 |
60387 |
390.2 |
-3.1 |
0.308 |
1 |
1 |
0 |
0.000 |
10 |
15 |
|
A |
28 |
9 |
60387 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
32 |
10 |
60387 |
270.3 |
-1.6 |
0.373 |
3 |
0 |
0 |
0.000 |
11 |
16 |
|
A |
17 |
4 |
60387 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
24 |
7 |
60338 |
182.4 |
1.0 |
0.739 |
2 |
0 |
0 |
0.000 |
12 |
17 |
|
A |
25 |
8 |
60387 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
16 |
2 |
6638 |
175.7 |
0.6 |
0.704 |
1 |
0 |
0 |
0.000 |
13 |
18 |
|
E |
18 |
7 |
60338 |
◊ |
A |
x,y-1,z |
1_545 |
19 |
4 |
60387 |
162.4 |
0.9 |
0.720 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
E |
21 |
7 |
60338 |
◊ |
G |
x-1/2,-y-1/2,-z |
4_445 |
19 |
2 |
6635 |
145.4 |
-0.0 |
0.620 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[EDO]A:1302 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
60387 |
111.4 |
3.4 |
0.470 |
1 |
0 |
0 |
0.000 |
16 |
21 |
|
[EDO]E:1302 |
4 |
1 |
183 |
f |
E |
x,y,z |
1_555 |
15 |
6 |
60338 |
110.6 |
3.5 |
0.459 |
1 |
0 |
0 |
0.000 |
17 |
22 |
|
E |
12 |
4 |
60338 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
13 |
6 |
60387 |
110.4 |
1.1 |
0.775 |
2 |
2 |
0 |
0.000 |
18 |
23 |
|
F |
16 |
4 |
8042 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
60387 |
109.1 |
-2.5 |
0.610 |
1 |
0 |
0 |
0.001 |
19 |
24 |
|
D |
12 |
3 |
2107 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
15 |
6 |
60338 |
108.5 |
-0.4 |
0.537 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[EDO]F:102 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
16 |
7 |
60338 |
81.1 |
2.8 |
0.509 |
2 |
0 |
0 |
0.000 |
21 |
26 |
|
[EDO]B:102 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
60387 |
80.0 |
2.8 |
0.511 |
3 |
0 |
0 |
0.000 |
22 |
27 |
|
E |
11 |
3 |
60338 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
11 |
2 |
2105 |
78.4 |
-0.2 |
0.370 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
8 |
3 |
60387 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
1 |
2107 |
66.0 |
-1.1 |
0.280 |
0 |
0 |
0 |
0.000 |
Average: |
72.2 |
-0.7 |
0.325 |
0 |
0 |
0 |
0.000 |
23 |
29 |
|
E |
7 |
2 |
60338 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
2 |
60387 |
77.5 |
1.4 |
0.850 |
1 |
3 |
0 |
0.000 |
24 |
30 |
|
[EDO]B:102 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
8015 |
62.0 |
1.1 |
0.867 |
4 |
0 |
0 |
0.012 |
25 |
31 |
|
[EDO]F:102 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
9 |
3 |
8042 |
59.4 |
0.8 |
0.859 |
4 |
0 |
0 |
0.018 |
26 |
32 |
|
[NA]B:101 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
8015 |
53.6 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.154 |
33 |
|
[NA]F:101 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
7 |
4 |
8042 |
52.7 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.154 |
Average: |
53.1 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.154 |
27 |
34 |
|
[NA]C:101 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
4 |
6638 |
49.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.250 |
28 |
35 |
|
[MG]A:1301 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
6 |
60387 |
45.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.046 |
36 |
|
[MG]E:1301 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
10 |
6 |
60338 |
42.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.046 |
Average: |
43.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.046 |
29 |
37 |
|
[MG]E:1301 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
8 |
3 |
8042 |
40.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.118 |
38 |
|
[MG]A:1301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
8015 |
40.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.118 |
Average: |
40.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.118 |
30 |
39 |
|
[NA]F:101 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
4 |
3 |
6635 |
36.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.080 |
40 |
|
[NA]B:101 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
3 |
6638 |
35.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
36.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.080 |
31 |
41 |
|
[NA]C:101 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
4 |
8015 |
32.1 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.063 |
32 |
42 |
|
[EDO]F:102 |
2 |
1 |
184 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
6635 |
13.8 |
-0.5 |
0.538 |
0 |
0 |
0 |
0.009 |
33 |
43 |
|
[EDO]B:102 |
2 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
6638 |
13.0 |
-0.4 |
0.541 |
0 |
0 |
0 |
0.007 |
34 |
44 |
|
F |
2 |
1 |
8042 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8015 |
4.1 |
-0.4 |
0.313 |
0 |
0 |
0 |
0.000 |
|