## |
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 |
72 |
20 |
23414 |
◊ |
A |
x,y,z |
1_555 |
70 |
20 |
22695 |
599.6 |
0.4 |
0.805 |
5 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
62 |
17 |
22695 |
x |
A |
x-y,x,z-1/6 |
2_554 |
62 |
17 |
22695 |
582.4 |
-3.1 |
0.503 |
5 |
3 |
0 |
0.000 |
3 |
|
B |
59 |
18 |
23414 |
x |
B |
x-y,x,z-1/6 |
2_554 |
54 |
15 |
23414 |
560.3 |
-3.5 |
0.365 |
5 |
4 |
0 |
0.000 |
Average: |
571.3 |
-3.3 |
0.434 |
5 |
4 |
0 |
0.000 |
3 |
4 |
|
[MG9]B:701 |
32 |
1 |
679 |
f |
B |
x,y,z |
1_555 |
80 |
32 |
23414 |
491.4 |
5.1 |
0.385 |
10 |
0 |
0 |
0.000 |
5 |
|
[MG9]A:701 |
33 |
1 |
676 |
f |
A |
x,y,z |
1_555 |
78 |
29 |
22695 |
486.0 |
4.3 |
0.334 |
9 |
0 |
0 |
0.000 |
Average: |
488.7 |
4.7 |
0.359 |
10 |
0 |
0 |
0.000 |
4 |
6 |
|
[S6P]A:702 |
16 |
1 |
395 |
f |
A |
x,y,z |
1_555 |
49 |
22 |
22695 |
283.9 |
-3.9 |
0.614 |
17 |
0 |
0 |
0.100 |
7 |
|
[S6P]B:702 |
16 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
48 |
22 |
23414 |
283.7 |
-3.8 |
0.625 |
15 |
0 |
0 |
0.100 |
Average: |
283.8 |
-3.9 |
0.619 |
16 |
0 |
0 |
0.100 |
5 |
8 |
|
A |
24 |
9 |
22695 |
◊ |
B |
-x+1,-y,z-1/2 |
4_654 |
26 |
9 |
23414 |
202.9 |
-0.4 |
0.629 |
1 |
0 |
0 |
0.000 |
6 |
9 |
|
[GOL]B:716 |
6 |
1 |
223 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
23414 |
152.1 |
0.4 |
0.654 |
5 |
0 |
0 |
0.003 |
7 |
10 |
|
[IOD]A:704 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
22695 |
101.3 |
-0.6 |
0.678 |
0 |
0 |
0 |
0.005 |
11 |
|
[IOD]B:704 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
20 |
11 |
23414 |
98.0 |
-0.5 |
0.658 |
0 |
0 |
0 |
0.005 |
Average: |
99.6 |
-0.5 |
0.668 |
0 |
0 |
0 |
0.005 |
8 |
12 |
|
[IOD]A:707 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
22695 |
98.1 |
0.2 |
0.814 |
0 |
0 |
0 |
0.000 |
13 |
|
[IOD]B:706 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
23414 |
90.5 |
-0.1 |
0.748 |
0 |
0 |
0 |
0.000 |
Average: |
94.3 |
0.0 |
0.781 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
[SO4]B:719 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
23414 |
97.0 |
-14.0 |
0.733 |
0 |
0 |
0 |
0.027 |
10 |
15 |
|
[IOD]A:703 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
22695 |
88.2 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
16 |
|
[IOD]B:703 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
23414 |
86.8 |
0.1 |
0.788 |
0 |
0 |
0 |
0.000 |
Average: |
87.5 |
0.1 |
0.787 |
0 |
0 |
0 |
0.000 |
11 |
17 |
|
[IOD]B:711 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
23414 |
87.0 |
-0.1 |
0.738 |
0 |
0 |
0 |
0.001 |
18 |
|
[IOD]A:710 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
22695 |
83.1 |
-0.1 |
0.737 |
0 |
0 |
0 |
0.001 |
Average: |
85.0 |
-0.1 |
0.738 |
0 |
0 |
0 |
0.001 |
12 |
19 |
|
[SO4]B:718 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
23414 |
86.4 |
-13.4 |
0.548 |
1 |
0 |
0 |
0.026 |
13 |
20 |
|
A |
10 |
2 |
22695 |
◊ |
B |
x,y,z-1 |
1_554 |
9 |
3 |
23414 |
86.2 |
-2.5 |
0.102 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[IOD]B:713 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
23414 |
85.6 |
-0.4 |
0.638 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[IOD]B:710 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
23414 |
82.0 |
-0.2 |
0.687 |
0 |
0 |
0 |
0.000 |
23 |
|
[IOD]A:709 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
22695 |
78.0 |
-0.1 |
0.745 |
0 |
0 |
0 |
0.000 |
Average: |
80.0 |
-0.1 |
0.716 |
0 |
0 |
0 |
0.001 |
16 |
24 |
|
[IOD]B:708 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
23414 |
79.6 |
-0.1 |
0.718 |
0 |
0 |
0 |
0.000 |
25 |
|
[IOD]A:708 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
22695 |
76.5 |
-0.0 |
0.775 |
0 |
0 |
0 |
0.000 |
Average: |
78.1 |
-0.1 |
0.746 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
[SO4]B:717 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
23414 |
79.5 |
-10.5 |
0.770 |
0 |
0 |
0 |
0.020 |
18 |
27 |
|
[IOD]B:715 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
23414 |
77.7 |
0.3 |
0.838 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
[IOD]A:711 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
22695 |
74.8 |
-0.2 |
0.724 |
0 |
0 |
0 |
0.001 |
29 |
|
[IOD]B:712 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
23414 |
74.7 |
-0.2 |
0.678 |
0 |
0 |
0 |
0.001 |
Average: |
74.8 |
-0.2 |
0.701 |
0 |
0 |
0 |
0.001 |
20 |
30 |
|
[IOD]A:705 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
22695 |
74.5 |
0.2 |
0.826 |
0 |
0 |
0 |
0.000 |
31 |
|
[IOD]B:705 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
23414 |
74.3 |
0.3 |
0.817 |
0 |
0 |
0 |
0.000 |
Average: |
74.4 |
0.2 |
0.822 |
0 |
0 |
0 |
0.000 |
21 |
32 |
|
[IOD]B:714 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
23414 |
73.0 |
0.0 |
0.755 |
0 |
0 |
0 |
0.002 |
33 |
|
[IOD]A:712 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
22695 |
69.4 |
-0.2 |
0.701 |
0 |
0 |
0 |
0.002 |
Average: |
71.2 |
-0.1 |
0.728 |
0 |
0 |
0 |
0.002 |
22 |
34 |
|
[IOD]B:707 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
23414 |
71.7 |
-0.4 |
0.582 |
0 |
0 |
0 |
0.001 |
35 |
|
[IOD]A:706 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
22695 |
71.1 |
-0.1 |
0.697 |
0 |
0 |
0 |
0.001 |
Average: |
71.4 |
-0.3 |
0.640 |
0 |
0 |
0 |
0.001 |
23 |
36 |
|
[IOD]A:713 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
22695 |
69.2 |
0.1 |
0.776 |
0 |
0 |
0 |
0.000 |
37 |
|
[IOD]B:709 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
23414 |
66.4 |
-0.0 |
0.725 |
0 |
0 |
0 |
0.000 |
Average: |
67.8 |
0.0 |
0.750 |
0 |
0 |
0 |
0.000 |
24 |
38 |
|
[IOD]A:714 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
22695 |
58.8 |
-0.1 |
0.724 |
0 |
0 |
0 |
0.001 |
25 |
39 |
|
[IOD]A:714 |
1 |
1 |
144 |
◊ |
A |
x-y,x,z-1/6 |
2_554 |
9 |
3 |
22695 |
43.2 |
0.2 |
0.841 |
0 |
0 |
0 |
0.000 |
26 |
40 |
|
A |
9 |
3 |
22695 |
x |
A |
-y,x-y-1,z-1/3 |
3_544 |
7 |
4 |
22695 |
39.2 |
0.1 |
0.638 |
0 |
0 |
0 |
0.000 |
27 |
41 |
|
[IOD]B:711 |
1 |
1 |
144 |
f |
[MG9]B:701 |
x,y,z |
1_555 |
4 |
1 |
679 |
32.7 |
0.7 |
0.610 |
0 |
0 |
0 |
0.000 |
42 |
|
[IOD]A:710 |
1 |
1 |
144 |
f |
[MG9]A:701 |
x,y,z |
1_555 |
4 |
1 |
676 |
29.9 |
0.7 |
0.602 |
0 |
0 |
0 |
0.000 |
Average: |
31.3 |
0.7 |
0.606 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
[IOD]B:714 |
1 |
1 |
144 |
◊ |
[IOD]A:712 |
x,y,z |
1_555 |
1 |
1 |
144 |
31.0 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
[IOD]B:715 |
1 |
1 |
144 |
f |
[IOD]B:709 |
x,y,z |
1_555 |
1 |
1 |
144 |
25.5 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
45 |
|
[IOD]A:712 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
23414 |
25.5 |
-0.1 |
0.669 |
0 |
0 |
0 |
0.000 |
46 |
|
[IOD]B:714 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
22695 |
19.8 |
-0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
Average: |
22.6 |
-0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
31 |
47 |
|
[SO4]B:717 |
3 |
1 |
188 |
f |
[IOD]B:707 |
x,y,z |
1_555 |
1 |
1 |
144 |
18.6 |
-2.1 |
0.996 |
0 |
0 |
0 |
0.004 |
|