## |
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 |
|
I |
836 |
224 |
62232 |
◊ |
H |
x,y,z |
1_555 |
776 |
188 |
67533 |
7892.2 |
-84.5 |
0.000 |
90 |
26 |
0 |
0.940 |
2 |
|
D |
827 |
221 |
61624 |
◊ |
C |
x,y,z |
1_555 |
782 |
194 |
66965 |
7842.1 |
-89.3 |
0.000 |
85 |
26 |
0 |
0.940 |
Average: |
7867.2 |
-86.9 |
0.000 |
88 |
26 |
0 |
0.940 |
2 |
3 |
|
X |
287 |
75 |
32345 |
◊ |
D |
x,y,z |
1_555 |
284 |
79 |
61624 |
2794.5 |
-25.8 |
0.082 |
26 |
19 |
0 |
0.831 |
4 |
|
Y |
286 |
72 |
32715 |
◊ |
I |
x,y,z |
1_555 |
283 |
77 |
62232 |
2740.3 |
-28.8 |
0.045 |
22 |
16 |
0 |
0.831 |
Average: |
2767.4 |
-27.3 |
0.063 |
24 |
18 |
0 |
0.831 |
3 |
5 |
|
X |
222 |
59 |
32345 |
◊ |
C |
x,y,z |
1_555 |
218 |
57 |
66965 |
2045.4 |
-23.0 |
0.051 |
14 |
5 |
0 |
1.000 |
6 |
|
Y |
212 |
57 |
32715 |
◊ |
H |
x,y,z |
1_555 |
190 |
59 |
67533 |
1893.4 |
-18.8 |
0.083 |
9 |
3 |
0 |
1.000 |
Average: |
1969.4 |
-20.9 |
0.067 |
12 |
4 |
0 |
1.000 |
4 |
7 |
|
B |
205 |
55 |
18516 |
◊ |
A |
x,y,z |
1_555 |
190 |
50 |
14115 |
2030.3 |
-25.1 |
0.023 |
13 |
4 |
0 |
1.000 |
5 |
8 |
|
G |
188 |
47 |
13683 |
◊ |
F |
x,y,z |
1_555 |
181 |
48 |
14369 |
1857.0 |
-20.4 |
0.061 |
12 |
5 |
0 |
1.000 |
6 |
9 |
|
H |
192 |
55 |
67533 |
◊ |
F |
x,y,z |
1_555 |
196 |
56 |
14369 |
1761.0 |
-2.7 |
0.695 |
24 |
7 |
0 |
1.000 |
10 |
|
C |
197 |
58 |
66965 |
◊ |
A |
x,y,z |
1_555 |
189 |
51 |
14115 |
1721.5 |
-0.3 |
0.747 |
28 |
9 |
0 |
1.000 |
Average: |
1741.2 |
-1.5 |
0.721 |
26 |
8 |
0 |
1.000 |
7 |
11 |
|
I |
152 |
53 |
62232 |
◊ |
D |
x,y,z |
1_555 |
168 |
51 |
61624 |
1474.1 |
-2.5 |
0.695 |
9 |
4 |
0 |
0.001 |
8 |
12 |
|
E |
119 |
30 |
7167 |
◊ |
D |
x,y,z |
1_555 |
149 |
40 |
61624 |
1393.3 |
-4.7 |
0.411 |
10 |
5 |
0 |
0.618 |
13 |
|
J |
122 |
30 |
5758 |
◊ |
I |
x,y,z |
1_555 |
156 |
40 |
62232 |
1381.0 |
-8.6 |
0.235 |
9 |
6 |
0 |
0.618 |
Average: |
1387.2 |
-6.6 |
0.323 |
10 |
6 |
0 |
0.618 |
9 |
14 |
|
H |
100 |
31 |
67533 |
◊ |
C |
-x-1,y-1/2,-z+1/2 |
3_445 |
108 |
31 |
66965 |
967.2 |
5.8 |
0.901 |
14 |
11 |
0 |
0.000 |
10 |
15 |
|
D |
96 |
26 |
61624 |
◊ |
B |
x,y,z |
1_555 |
96 |
29 |
18516 |
892.2 |
-5.1 |
0.382 |
4 |
2 |
0 |
0.027 |
11 |
16 |
|
G |
101 |
30 |
13683 |
◊ |
I |
x,y,z |
1_555 |
91 |
25 |
62232 |
854.9 |
-4.8 |
0.355 |
7 |
4 |
0 |
0.042 |
12 |
17 |
|
C |
83 |
26 |
66965 |
◊ |
X |
x-1/2,-y+1/2,-z |
4_455 |
76 |
24 |
32345 |
681.5 |
2.0 |
0.751 |
5 |
4 |
0 |
0.000 |
13 |
18 |
|
I |
60 |
17 |
62232 |
◊ |
X |
-x-1,y-1/2,-z+1/2 |
3_445 |
68 |
21 |
32345 |
544.1 |
-1.6 |
0.565 |
1 |
0 |
0 |
0.000 |
19 |
|
Y |
65 |
19 |
32715 |
◊ |
D |
-x-1,y-1/2,-z+1/2 |
3_445 |
56 |
15 |
61624 |
499.6 |
-0.4 |
0.612 |
2 |
0 |
0 |
0.000 |
Average: |
521.8 |
-1.0 |
0.589 |
2 |
0 |
0 |
0.000 |
14 |
20 |
|
C |
57 |
18 |
66965 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
50 |
12 |
7167 |
543.8 |
-4.4 |
0.271 |
3 |
2 |
0 |
0.000 |
15 |
21 |
|
C |
52 |
16 |
66965 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
43 |
13 |
61624 |
477.7 |
1.5 |
0.735 |
1 |
1 |
0 |
0.000 |
16 |
22 |
|
Y |
51 |
14 |
32715 |
◊ |
X |
x,y-1,z |
1_545 |
58 |
14 |
32345 |
476.1 |
0.5 |
0.670 |
3 |
4 |
0 |
0.000 |
17 |
23 |
|
B |
56 |
19 |
18516 |
◊ |
H |
-x-1/2,-y,z-1/2 |
2_454 |
46 |
15 |
67533 |
466.8 |
5.9 |
0.918 |
5 |
3 |
0 |
0.000 |
18 |
24 |
|
I |
53 |
16 |
62232 |
◊ |
D |
-x-1,y-1/2,-z+1/2 |
3_445 |
51 |
17 |
61624 |
445.3 |
-3.2 |
0.432 |
2 |
0 |
0 |
0.000 |
19 |
25 |
|
B |
37 |
11 |
18516 |
◊ |
F |
x-1/2,-y-1/2,-z |
4_445 |
41 |
14 |
14369 |
326.1 |
-2.4 |
0.392 |
2 |
0 |
0 |
0.000 |
20 |
26 |
|
D |
41 |
12 |
61624 |
◊ |
Y |
x-1/2,-y-1/2,-z |
4_445 |
34 |
11 |
32715 |
317.8 |
0.4 |
0.674 |
3 |
4 |
0 |
0.000 |
21 |
27 |
|
C |
34 |
9 |
66965 |
◊ |
B |
x,y,z |
1_555 |
32 |
9 |
18516 |
302.8 |
2.1 |
0.803 |
6 |
6 |
0 |
0.005 |
22 |
28 |
|
G |
33 |
10 |
13683 |
◊ |
H |
x,y,z |
1_555 |
36 |
9 |
67533 |
298.5 |
1.5 |
0.751 |
3 |
3 |
0 |
0.001 |
23 |
29 |
|
B |
31 |
8 |
18516 |
◊ |
I |
-x-1/2,-y,z-1/2 |
2_454 |
34 |
10 |
62232 |
289.2 |
-2.8 |
0.355 |
3 |
0 |
0 |
0.000 |
24 |
30 |
|
E |
20 |
6 |
7167 |
◊ |
C |
x,y,z |
1_555 |
31 |
8 |
66965 |
235.1 |
0.2 |
0.609 |
1 |
0 |
0 |
0.001 |
31 |
|
J |
24 |
8 |
5758 |
◊ |
H |
x,y,z |
1_555 |
32 |
9 |
67533 |
230.4 |
0.7 |
0.641 |
2 |
0 |
0 |
0.001 |
Average: |
232.7 |
0.4 |
0.625 |
2 |
0 |
0 |
0.001 |
25 |
32 |
|
A |
25 |
10 |
14115 |
◊ |
H |
-x-1/2,-y,z-1/2 |
2_454 |
24 |
8 |
67533 |
212.6 |
0.6 |
0.677 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
Y |
20 |
11 |
32715 |
◊ |
X |
-x-1,y-1/2,-z+1/2 |
3_445 |
21 |
9 |
32345 |
201.4 |
-1.5 |
0.433 |
1 |
1 |
0 |
0.000 |
27 |
34 |
|
C |
27 |
12 |
66965 |
◊ |
G |
x-1/2,-y+1/2,-z |
4_455 |
28 |
10 |
13683 |
200.3 |
-0.8 |
0.444 |
1 |
0 |
0 |
0.000 |
28 |
35 |
|
B |
18 |
8 |
18516 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
13 |
4 |
67533 |
140.6 |
2.8 |
0.857 |
3 |
3 |
0 |
0.000 |
29 |
36 |
|
Y |
16 |
8 |
32715 |
◊ |
I |
-x-1,y-1/2,-z+1/2 |
3_445 |
13 |
5 |
62232 |
135.3 |
-0.1 |
0.605 |
0 |
0 |
0 |
0.000 |
37 |
|
D |
7 |
3 |
61624 |
◊ |
X |
-x-1,y-1/2,-z+1/2 |
3_445 |
11 |
6 |
32345 |
70.6 |
-0.6 |
0.508 |
0 |
0 |
0 |
0.000 |
Average: |
102.9 |
-0.3 |
0.557 |
0 |
0 |
0 |
0.000 |
30 |
38 |
|
H |
18 |
9 |
67533 |
◊ |
X |
-x-1,y-1/2,-z+1/2 |
3_445 |
18 |
8 |
32345 |
123.3 |
1.2 |
0.728 |
0 |
0 |
0 |
0.000 |
39 |
|
Y |
9 |
6 |
32715 |
◊ |
C |
-x-1,y-1/2,-z+1/2 |
3_445 |
11 |
6 |
66965 |
63.2 |
1.3 |
0.793 |
0 |
0 |
0 |
0.000 |
Average: |
93.3 |
1.3 |
0.760 |
0 |
0 |
0 |
0.000 |
31 |
40 |
|
D |
14 |
4 |
61624 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
10 |
3 |
67533 |
101.2 |
-2.0 |
0.183 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
[MG]I:1503 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
8 |
4 |
62232 |
51.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.382 |
42 |
|
[MG]D:1504 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
61624 |
50.7 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.382 |
Average: |
51.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.382 |
33 |
43 |
|
C |
8 |
3 |
66965 |
◊ |
Y |
x-1/2,-y-1/2,-z |
4_445 |
4 |
2 |
32715 |
47.8 |
-0.5 |
0.439 |
0 |
0 |
0 |
0.000 |
34 |
44 |
|
C |
2 |
1 |
66965 |
◊ |
H |
x-1,y,z |
1_455 |
3 |
1 |
67533 |
24.0 |
0.6 |
0.838 |
0 |
0 |
0 |
0.000 |
35 |
45 |
|
X |
2 |
1 |
32345 |
◊ |
G |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
13683 |
9.7 |
0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
36 |
46 |
|
[MG]D:1504 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
66965 |
0.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|