| ## |
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 |
494 |
147 |
21369 |
◊ |
A |
x,y,z |
1_555 |
367 |
68 |
8726 |
4285.9 |
-64.5 |
0.121 |
80 |
5 |
2 |
0.663 |
2 |
|
F |
496 |
151 |
21390 |
◊ |
E |
x,y,z |
1_555 |
370 |
67 |
8749 |
4242.1 |
-62.0 |
0.140 |
80 |
5 |
2 |
0.663 |
3 |
|
D |
484 |
142 |
21655 |
◊ |
C |
x,y,z |
1_555 |
352 |
67 |
8159 |
4207.0 |
-64.5 |
0.131 |
77 |
5 |
2 |
0.663 |
| Average: |
4245.0 |
-63.6 |
0.131 |
79 |
5 |
2 |
0.663 |
| 2 |
4 |
|
D |
176 |
59 |
21655 |
◊ |
B |
x,y,z |
1_555 |
176 |
55 |
21369 |
1647.7 |
-15.3 |
0.404 |
19 |
1 |
0 |
0.279 |
5 |
|
F |
169 |
55 |
21390 |
◊ |
D |
x,y,z |
1_555 |
177 |
54 |
21655 |
1613.4 |
-17.0 |
0.319 |
16 |
0 |
0 |
0.279 |
6 |
|
F |
167 |
51 |
21390 |
◊ |
B |
x,y,z |
1_555 |
167 |
53 |
21369 |
1578.3 |
-14.8 |
0.441 |
21 |
2 |
0 |
0.279 |
| Average: |
1613.1 |
-15.7 |
0.388 |
19 |
1 |
0 |
0.279 |
| 3 |
7 |
|
D |
102 |
34 |
21655 |
◊ |
A |
x,y,z |
1_555 |
87 |
26 |
8726 |
892.2 |
-1.8 |
0.889 |
7 |
1 |
0 |
0.111 |
8 |
|
B |
105 |
36 |
21369 |
◊ |
E |
x,y,z |
1_555 |
75 |
23 |
8749 |
814.3 |
-4.2 |
0.788 |
11 |
1 |
0 |
0.111 |
9 |
|
F |
65 |
21 |
21390 |
◊ |
C |
x,y,z |
1_555 |
58 |
21 |
8159 |
583.4 |
-4.2 |
0.729 |
5 |
1 |
0 |
0.111 |
| Average: |
763.3 |
-3.4 |
0.802 |
8 |
1 |
0 |
0.111 |
| 4 |
10 |
|
F |
62 |
24 |
21390 |
x |
B |
y,x,-z |
6_555 |
66 |
20 |
21369 |
555.5 |
-1.2 |
0.688 |
6 |
2 |
0 |
0.000 |
11 |
|
D |
59 |
17 |
21655 |
x |
D |
-y+1/2,x-1/2,z+1/4 |
2_545 |
58 |
24 |
21655 |
553.7 |
-1.1 |
0.677 |
5 |
2 |
0 |
0.000 |
12 |
|
B |
59 |
21 |
21369 |
x |
F |
-y+1/2,x-1/2,z+1/4 |
2_545 |
57 |
17 |
21390 |
497.3 |
-2.2 |
0.643 |
5 |
2 |
0 |
0.000 |
| Average: |
535.5 |
-1.5 |
0.669 |
5 |
2 |
0 |
0.000 |
| 5 |
13 |
|
B |
35 |
12 |
21369 |
◊ |
B |
y,x,-z |
6_555 |
34 |
12 |
21369 |
330.9 |
-3.2 |
0.475 |
4 |
0 |
0 |
0.000 |
14 |
|
D |
22 |
10 |
21655 |
◊ |
F |
-y+1/2,x-1/2,z+1/4 |
2_545 |
22 |
10 |
21390 |
166.3 |
1.5 |
0.879 |
2 |
0 |
0 |
0.000 |
| Average: |
248.6 |
-0.9 |
0.677 |
3 |
0 |
0 |
0.000 |
| 6 |
15 |
|
F |
20 |
7 |
21390 |
◊ |
D |
-y,-x,-z-1/2 |
8_554 |
17 |
6 |
21655 |
149.6 |
0.5 |
0.791 |
4 |
0 |
0 |
0.000 |
| 7 |
16 |
|
B |
19 |
5 |
21369 |
◊ |
E |
y,x,-z |
6_555 |
18 |
5 |
8749 |
145.2 |
-0.8 |
0.675 |
2 |
0 |
0 |
0.000 |
| 8 |
17 |
|
B |
18 |
5 |
21369 |
◊ |
E |
-y,-x,-z-1/2 |
8_554 |
14 |
5 |
8749 |
113.2 |
-0.5 |
0.684 |
1 |
0 |
0 |
0.000 |
| 9 |
18 |
|
[SO4]D:602 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
21655 |
110.8 |
-16.1 |
0.742 |
2 |
0 |
0 |
0.234 |
| 10 |
19 |
|
[SO4]B:602 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
21369 |
110.3 |
-15.5 |
0.768 |
2 |
0 |
0 |
0.198 |
| 11 |
20 |
|
[SO4]F:601 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
21390 |
109.6 |
-15.7 |
0.768 |
3 |
0 |
0 |
0.106 |
| 12 |
21 |
|
D |
13 |
3 |
21655 |
◊ |
C |
-y+1/2,x-1/2,z+1/4 |
2_545 |
15 |
5 |
8159 |
106.6 |
-0.5 |
0.709 |
1 |
0 |
0 |
0.000 |
22 |
|
A |
9 |
4 |
8726 |
◊ |
F |
-y+1/2,x-1/2,z+1/4 |
2_545 |
13 |
4 |
21390 |
86.1 |
-1.2 |
0.497 |
0 |
0 |
0 |
0.000 |
| Average: |
96.3 |
-0.8 |
0.603 |
1 |
0 |
0 |
0.000 |
| 13 |
23 |
|
B |
13 |
7 |
21369 |
◊ |
D |
-y+1/2,x-1/2,z+1/4 |
2_545 |
11 |
5 |
21655 |
98.3 |
-0.7 |
0.580 |
0 |
0 |
0 |
0.000 |
24 |
|
F |
11 |
5 |
21390 |
◊ |
F |
y,x,-z |
6_555 |
11 |
5 |
21390 |
80.8 |
-0.5 |
0.604 |
0 |
0 |
0 |
0.000 |
| Average: |
89.6 |
-0.6 |
0.592 |
0 |
0 |
0 |
0.000 |
| 14 |
25 |
|
[SO4]F:602 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
12 |
4 |
21390 |
93.5 |
-12.2 |
0.895 |
2 |
0 |
0 |
0.082 |
| 15 |
26 |
|
[SO4]B:603 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
21369 |
91.3 |
-12.5 |
0.893 |
3 |
0 |
0 |
0.167 |
| 16 |
27 |
|
[SO4]F:603 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
21390 |
90.6 |
-11.8 |
0.900 |
5 |
0 |
0 |
0.087 |
| 17 |
28 |
|
E |
12 |
4 |
8749 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
9 |
3 |
8726 |
87.9 |
0.4 |
0.804 |
1 |
1 |
0 |
0.000 |
| 18 |
29 |
|
[SO4]D:603 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
21655 |
87.7 |
-12.1 |
0.896 |
4 |
0 |
0 |
0.191 |
| 19 |
30 |
|
[SO4]D:601 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
21655 |
86.0 |
-11.8 |
0.898 |
4 |
0 |
0 |
0.187 |
| 20 |
31 |
|
[SO4]B:601 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
21369 |
83.3 |
-10.9 |
0.909 |
4 |
0 |
0 |
0.153 |
| 21 |
32 |
|
D |
9 |
6 |
21655 |
f |
[SO4]D:605 |
-y+1/2,x-1/2,z+1/4 |
2_545 |
5 |
1 |
185 |
81.3 |
-10.8 |
0.922 |
4 |
0 |
0 |
0.174 |
| 22 |
33 |
|
[SO4]B:604 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
21369 |
80.7 |
-9.5 |
0.954 |
3 |
0 |
0 |
0.131 |
| 23 |
34 |
|
[SO4]B:605 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
21369 |
74.4 |
-11.2 |
0.780 |
4 |
0 |
0 |
0.156 |
| 24 |
35 |
|
F |
6 |
3 |
21390 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
9 |
4 |
8726 |
73.2 |
-0.1 |
0.539 |
1 |
0 |
0 |
0.000 |
| 25 |
36 |
|
[SO4]D:604 |
5 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
13 |
7 |
21655 |
73.2 |
-9.6 |
0.865 |
2 |
0 |
0 |
0.145 |
| 26 |
37 |
|
[SO4]F:604 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
21390 |
68.9 |
-9.0 |
0.879 |
2 |
0 |
0 |
0.061 |
| 27 |
38 |
|
F |
10 |
3 |
21390 |
◊ |
F |
-y,-x,-z-1/2 |
8_554 |
10 |
3 |
21390 |
55.5 |
-0.9 |
0.504 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
[SO4]B:604 |
4 |
1 |
184 |
◊ |
F |
y,x,-z |
6_555 |
9 |
4 |
21390 |
55.1 |
-6.9 |
0.611 |
0 |
0 |
0 |
0.000 |
| 29 |
40 |
|
[SO4]B:601 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
8 |
2 |
8749 |
50.5 |
-6.0 |
0.883 |
2 |
0 |
0 |
0.083 |
| 30 |
41 |
|
B |
9 |
2 |
21369 |
◊ |
B |
-y,-x,-z-1/2 |
8_554 |
9 |
2 |
21369 |
48.4 |
0.5 |
0.787 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[SO4]D:601 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
8726 |
48.1 |
-5.9 |
0.893 |
2 |
0 |
0 |
0.011 |
| 32 |
43 |
|
F |
3 |
2 |
21390 |
◊ |
C |
-y,-x,-z-1/2 |
8_554 |
2 |
1 |
8159 |
36.2 |
-0.2 |
0.379 |
0 |
0 |
0 |
0.000 |
| 33 |
44 |
|
[SO4]D:605 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
21655 |
33.4 |
-4.6 |
0.435 |
0 |
0 |
0 |
0.000 |
| 34 |
45 |
|
[SO4]B:601 |
3 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
21390 |
27.8 |
-3.6 |
0.583 |
0 |
0 |
0 |
0.014 |
| 35 |
46 |
|
[SO4]D:604 |
3 |
1 |
184 |
◊ |
[SO4]D:605 |
-y+1/2,x-1/2,z+1/4 |
2_545 |
1 |
1 |
185 |
21.2 |
-5.0 |
0.891 |
0 |
0 |
0 |
0.069 |
| 36 |
47 |
|
[SO4]D:601 |
2 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
21369 |
20.3 |
-2.7 |
0.692 |
0 |
0 |
0 |
0.010 |
| 37 |
48 |
|
[SO4]F:602 |
3 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
21655 |
18.0 |
-2.4 |
0.687 |
0 |
0 |
0 |
0.009 |
| 38 |
49 |
|
B |
2 |
1 |
21369 |
◊ |
[SO4]D:605 |
-y+1/2,x-1/2,z+1/4 |
2_545 |
1 |
1 |
185 |
8.0 |
-0.9 |
0.769 |
0 |
0 |
0 |
0.003 |
| 39 |
50 |
|
F |
4 |
2 |
21390 |
◊ |
E |
-y,-x,-z-1/2 |
8_554 |
1 |
1 |
8749 |
6.9 |
0.2 |
0.713 |
0 |
0 |
0 |
0.000 |
| 40 |
51 |
|
F |
1 |
1 |
21390 |
◊ |
B |
-y,-x,-z-1/2 |
8_554 |
2 |
1 |
21369 |
1.7 |
-0.1 |
0.528 |
0 |
0 |
0 |
0.000 |
|