## |
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 |
43 |
10 |
1293 |
◊ |
C |
x,y,z |
1_555 |
57 |
14 |
3605 |
474.5 |
-7.3 |
0.671 |
1 |
0 |
0 |
0.895 |
2 |
|
F |
40 |
9 |
1292 |
◊ |
E |
x,y,z |
1_555 |
57 |
13 |
3730 |
464.1 |
-7.8 |
0.567 |
0 |
0 |
0 |
0.895 |
3 |
|
B |
39 |
9 |
1296 |
◊ |
A |
x,y,z |
1_555 |
58 |
14 |
3761 |
454.2 |
-7.8 |
0.565 |
0 |
0 |
0 |
0.895 |
Average: |
464.3 |
-7.7 |
0.601 |
0 |
0 |
0 |
0.895 |
2 |
4 |
|
E |
34 |
11 |
3730 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
38 |
10 |
3761 |
335.0 |
-5.9 |
0.164 |
0 |
0 |
0 |
0.141 |
3 |
5 |
|
C |
32 |
9 |
3605 |
◊ |
E |
-y,x-y+1,z-1/3 |
2_564 |
35 |
8 |
3730 |
291.9 |
-0.0 |
0.734 |
1 |
0 |
0 |
0.000 |
6 |
|
A |
32 |
8 |
3761 |
◊ |
A |
y,x,-z |
4_555 |
32 |
8 |
3761 |
275.8 |
-0.5 |
0.685 |
1 |
0 |
0 |
0.000 |
Average: |
283.9 |
-0.3 |
0.709 |
1 |
0 |
0 |
0.000 |
4 |
7 |
|
A |
36 |
11 |
3761 |
◊ |
A |
-x,-x+y,-z-1/3 |
5_554 |
36 |
11 |
3761 |
275.0 |
-2.9 |
0.458 |
1 |
0 |
0 |
0.000 |
8 |
|
E |
32 |
10 |
3730 |
◊ |
C |
x,y,z |
1_555 |
30 |
9 |
3605 |
266.5 |
-2.6 |
0.446 |
2 |
0 |
0 |
0.000 |
Average: |
270.7 |
-2.8 |
0.452 |
2 |
0 |
0 |
0.000 |
5 |
9 |
|
C |
28 |
9 |
3605 |
◊ |
C |
-x,-x+y,-z-1/3 |
5_554 |
28 |
9 |
3605 |
268.3 |
-4.9 |
0.192 |
0 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
27 |
9 |
3761 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
27 |
9 |
3761 |
246.5 |
-1.9 |
0.506 |
1 |
0 |
0 |
0.000 |
11 |
|
C |
32 |
8 |
3605 |
◊ |
E |
x,y,z-1 |
1_554 |
26 |
8 |
3730 |
243.9 |
-2.3 |
0.480 |
1 |
0 |
0 |
0.000 |
Average: |
245.2 |
-2.1 |
0.493 |
1 |
0 |
0 |
0.000 |
7 |
12 |
|
C |
14 |
4 |
3605 |
◊ |
F |
x,y,z-1 |
1_554 |
12 |
4 |
1292 |
115.0 |
-0.6 |
0.803 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
12 |
4 |
3761 |
◊ |
A |
x-y,-y,-z+1/3 |
6_555 |
12 |
4 |
3761 |
106.4 |
0.2 |
0.695 |
0 |
0 |
0 |
0.000 |
14 |
|
E |
10 |
3 |
3730 |
◊ |
C |
-y,x-y+1,z+2/3 |
2_565 |
10 |
5 |
3605 |
86.1 |
-0.1 |
0.627 |
0 |
0 |
0 |
0.000 |
Average: |
96.2 |
0.0 |
0.661 |
0 |
0 |
0 |
0.000 |
9 |
15 |
|
B |
9 |
4 |
1296 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
11 |
3 |
3761 |
104.7 |
-0.7 |
0.707 |
0 |
0 |
0 |
0.000 |
16 |
|
D |
12 |
4 |
1293 |
◊ |
E |
x,y,z-1 |
1_554 |
11 |
4 |
3730 |
98.2 |
-0.5 |
0.816 |
0 |
0 |
0 |
0.000 |
Average: |
101.4 |
-0.6 |
0.761 |
0 |
0 |
0 |
0.000 |
10 |
17 |
|
[SO4]E:201 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
15 |
4 |
3730 |
93.5 |
-14.1 |
0.609 |
1 |
0 |
0 |
0.613 |
11 |
18 |
|
[GOL]E:202 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
14 |
6 |
3730 |
88.0 |
-0.9 |
0.455 |
0 |
0 |
0 |
0.038 |
12 |
19 |
|
[GOL]E:202 |
5 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
12 |
6 |
3605 |
80.6 |
0.1 |
0.668 |
2 |
0 |
0 |
0.000 |
13 |
20 |
|
[ACE]D:0 |
3 |
1 |
172 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
3605 |
59.0 |
-0.2 |
0.795 |
1 |
0 |
0 |
0.067 |
14 |
21 |
|
[ACE]F:0 |
3 |
1 |
171 |
◊ |
E |
x,y,z |
1_555 |
9 |
3 |
3730 |
57.9 |
-0.2 |
0.760 |
0 |
0 |
0 |
0.007 |
15 |
22 |
|
B |
5 |
3 |
1296 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
6 |
2 |
3761 |
56.3 |
0.3 |
0.839 |
1 |
0 |
0 |
0.000 |
23 |
|
C |
6 |
2 |
3605 |
◊ |
D |
-y,x-y+1,z-1/3 |
2_564 |
3 |
2 |
1293 |
43.8 |
-0.4 |
0.618 |
0 |
0 |
0 |
0.000 |
Average: |
50.1 |
-0.1 |
0.729 |
1 |
0 |
0 |
0.000 |
16 |
24 |
|
[ACE]B:0 |
3 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
3761 |
54.8 |
-0.3 |
0.748 |
0 |
0 |
0 |
0.039 |
17 |
25 |
|
F |
3 |
2 |
1292 |
◊ |
E |
-y,x-y+1,z-1/3 |
2_564 |
7 |
2 |
3730 |
54.0 |
0.2 |
0.715 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[ACE]F:0 |
3 |
1 |
171 |
cf |
F |
x,y,z |
1_555 |
7 |
2 |
1292 |
53.7 |
-0.3 |
0.908 |
0 |
0 |
0 |
0.100 |
19 |
27 |
|
B |
5 |
1 |
1296 |
◊ |
B |
-x,-x+y,-z+2/3 |
5_555 |
5 |
1 |
1296 |
52.0 |
-1.0 |
0.714 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[ACE]B:0 |
3 |
1 |
171 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
7 |
2 |
3761 |
51.1 |
0.1 |
0.810 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[ACE]B:0 |
3 |
1 |
171 |
cf |
B |
x,y,z |
1_555 |
6 |
2 |
1296 |
50.3 |
-0.1 |
0.906 |
1 |
0 |
0 |
0.100 |
22 |
30 |
|
C |
3 |
2 |
3605 |
x |
C |
-y,x-y+1,z-1/3 |
2_564 |
4 |
2 |
3605 |
49.6 |
0.6 |
0.757 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
1 |
1 |
3761 |
x |
A |
-y,x-y,z-1/3 |
2_554 |
4 |
1 |
3761 |
15.7 |
0.3 |
0.772 |
0 |
0 |
0 |
0.000 |
Average: |
32.7 |
0.4 |
0.764 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[ACE]D:0 |
3 |
1 |
172 |
cf |
D |
x,y,z |
1_555 |
7 |
2 |
1293 |
47.3 |
-0.1 |
0.908 |
1 |
0 |
0 |
0.100 |
24 |
33 |
|
C |
9 |
2 |
3605 |
◊ |
[ACE]D:0 |
-y,x-y+1,z-1/3 |
2_564 |
3 |
1 |
172 |
46.3 |
-0.4 |
0.807 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
D |
5 |
1 |
1293 |
◊ |
F |
x,y,z-1 |
1_554 |
5 |
1 |
1292 |
41.3 |
-0.8 |
0.737 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
[ACE]F:0 |
3 |
1 |
171 |
◊ |
E |
-y,x-y+1,z-1/3 |
2_564 |
6 |
2 |
3730 |
37.7 |
-0.5 |
0.784 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
[SO4]E:201 |
4 |
1 |
186 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
7 |
1 |
3761 |
28.2 |
-3.3 |
0.752 |
0 |
0 |
0 |
0.079 |
28 |
37 |
|
F |
3 |
1 |
1292 |
◊ |
C |
-x,-x+y,-z+2/3 |
5_555 |
3 |
2 |
3605 |
23.6 |
-0.8 |
0.421 |
0 |
0 |
0 |
0.000 |
29 |
38 |
|
D |
3 |
2 |
1293 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
3761 |
15.9 |
-0.4 |
0.597 |
0 |
0 |
0 |
0.000 |
39 |
|
B |
2 |
1 |
1296 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
3605 |
14.9 |
-0.5 |
0.494 |
0 |
0 |
0 |
0.000 |
Average: |
15.4 |
-0.5 |
0.545 |
0 |
0 |
0 |
0.000 |
30 |
40 |
|
C |
1 |
1 |
3605 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
3761 |
14.4 |
0.5 |
0.883 |
0 |
0 |
0 |
0.000 |
31 |
41 |
|
B |
4 |
2 |
1296 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
3730 |
14.2 |
-0.4 |
0.517 |
0 |
0 |
0 |
0.000 |
32 |
42 |
|
F |
2 |
1 |
1292 |
◊ |
C |
-y,x-y+1,z+2/3 |
2_565 |
2 |
2 |
3605 |
9.1 |
-0.1 |
0.629 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
D |
2 |
1 |
1293 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
3730 |
8.4 |
0.0 |
0.745 |
0 |
0 |
0 |
0.000 |
44 |
|
B |
2 |
1 |
1296 |
◊ |
A |
-x,-x+y,-z-1/3 |
5_554 |
1 |
1 |
3761 |
4.5 |
-0.0 |
0.740 |
0 |
0 |
0 |
0.000 |
Average: |
6.4 |
0.0 |
0.742 |
0 |
0 |
0 |
0.000 |
34 |
45 |
|
[ACE]D:0 |
1 |
1 |
172 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
3730 |
2.4 |
-0.1 |
0.619 |
0 |
0 |
0 |
0.000 |
|