| ## |
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 |
|
T |
218 |
61 |
12866 |
◊ |
S |
x,y,z |
1_555 |
204 |
52 |
12872 |
2090.8 |
-19.2 |
0.347 |
30 |
12 |
0 |
1.000 |
2 |
|
U |
216 |
61 |
12853 |
◊ |
T |
x,y,z |
1_555 |
200 |
51 |
12866 |
2081.1 |
-19.2 |
0.341 |
30 |
14 |
0 |
1.000 |
3 |
|
R |
216 |
61 |
12848 |
◊ |
Q |
x,y,z |
1_555 |
201 |
53 |
12870 |
2081.1 |
-19.0 |
0.351 |
30 |
13 |
0 |
1.000 |
4 |
|
Q |
213 |
60 |
12870 |
◊ |
P |
x,y,z |
1_555 |
201 |
52 |
12858 |
2073.9 |
-19.2 |
0.339 |
29 |
13 |
0 |
1.000 |
5 |
|
S |
220 |
61 |
12872 |
◊ |
R |
x,y,z |
1_555 |
199 |
51 |
12848 |
2068.1 |
-19.0 |
0.357 |
29 |
13 |
0 |
1.000 |
6 |
|
P |
214 |
60 |
12858 |
◊ |
O |
x,y,z |
1_555 |
201 |
52 |
12866 |
2067.4 |
-18.9 |
0.350 |
30 |
12 |
0 |
1.000 |
7 |
|
U |
199 |
51 |
12853 |
◊ |
O |
x,y,z |
1_555 |
212 |
60 |
12866 |
2065.0 |
-19.0 |
0.336 |
28 |
13 |
0 |
1.000 |
| Average: |
2075.4 |
-19.1 |
0.346 |
29 |
13 |
0 |
1.000 |
| 2 |
8 |
|
G |
142 |
33 |
12181 |
◊ |
F |
x,y,z |
1_555 |
162 |
41 |
12187 |
1415.4 |
-6.3 |
0.407 |
20 |
3 |
0 |
1.000 |
9 |
|
G |
156 |
41 |
12181 |
◊ |
A |
x,y,z |
1_555 |
140 |
33 |
12203 |
1408.2 |
-6.0 |
0.416 |
22 |
3 |
0 |
1.000 |
10 |
|
C |
142 |
33 |
12186 |
◊ |
B |
x,y,z |
1_555 |
157 |
41 |
12187 |
1408.2 |
-6.1 |
0.413 |
22 |
3 |
0 |
1.000 |
11 |
|
E |
134 |
32 |
12184 |
◊ |
D |
x,y,z |
1_555 |
160 |
41 |
12189 |
1398.0 |
-6.3 |
0.395 |
23 |
3 |
0 |
1.000 |
12 |
|
B |
135 |
32 |
12187 |
◊ |
A |
x,y,z |
1_555 |
158 |
41 |
12203 |
1395.1 |
-6.2 |
0.402 |
22 |
3 |
0 |
1.000 |
13 |
|
F |
137 |
33 |
12187 |
◊ |
E |
x,y,z |
1_555 |
159 |
41 |
12184 |
1392.8 |
-6.1 |
0.406 |
21 |
3 |
0 |
1.000 |
14 |
|
D |
135 |
32 |
12189 |
◊ |
C |
x,y,z |
1_555 |
160 |
41 |
12186 |
1383.7 |
-6.3 |
0.398 |
21 |
3 |
0 |
1.000 |
| Average: |
1400.2 |
-6.2 |
0.405 |
22 |
3 |
0 |
1.000 |
| 3 |
15 |
|
M |
68 |
25 |
10106 |
◊ |
L |
x,y,z |
1_555 |
71 |
21 |
10115 |
705.4 |
-3.5 |
0.531 |
10 |
5 |
0 |
0.522 |
16 |
|
N |
73 |
25 |
10116 |
◊ |
M |
x,y,z |
1_555 |
73 |
21 |
10106 |
704.0 |
-3.2 |
0.586 |
11 |
5 |
0 |
0.522 |
17 |
|
K |
71 |
25 |
10126 |
◊ |
J |
x,y,z |
1_555 |
69 |
21 |
10110 |
699.1 |
-3.1 |
0.573 |
11 |
5 |
0 |
0.522 |
18 |
|
N |
71 |
21 |
10116 |
◊ |
H |
x,y,z |
1_555 |
70 |
25 |
10117 |
698.7 |
-3.3 |
0.558 |
11 |
5 |
0 |
0.522 |
19 |
|
L |
73 |
25 |
10115 |
◊ |
K |
x,y,z |
1_555 |
68 |
21 |
10126 |
697.7 |
-3.3 |
0.556 |
11 |
5 |
0 |
0.522 |
20 |
|
J |
71 |
25 |
10110 |
◊ |
I |
x,y,z |
1_555 |
69 |
21 |
10110 |
694.2 |
-3.3 |
0.543 |
10 |
5 |
0 |
0.522 |
21 |
|
I |
68 |
25 |
10110 |
◊ |
H |
x,y,z |
1_555 |
70 |
21 |
10117 |
689.1 |
-3.2 |
0.559 |
10 |
5 |
0 |
0.522 |
| Average: |
698.3 |
-3.3 |
0.558 |
11 |
5 |
0 |
0.522 |
| 4 |
22 |
|
N |
72 |
19 |
10116 |
◊ |
M |
-x+1,y,-z+1 |
2_656 |
69 |
18 |
10106 |
608.1 |
-1.8 |
0.703 |
12 |
0 |
0 |
0.211 |
23 |
|
L |
68 |
18 |
10115 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
69 |
18 |
10117 |
596.1 |
-1.7 |
0.711 |
12 |
0 |
0 |
0.211 |
24 |
|
K |
70 |
18 |
10126 |
◊ |
I |
-x+1,y,-z+1 |
2_656 |
67 |
18 |
10110 |
595.4 |
-1.6 |
0.717 |
12 |
0 |
0 |
0.211 |
25 |
|
J |
67 |
18 |
10110 |
◊ |
J |
-x+1,y,-z+1 |
2_656 |
66 |
18 |
10110 |
592.0 |
-1.5 |
0.718 |
13 |
0 |
0 |
0.211 |
| Average: |
597.9 |
-1.6 |
0.712 |
12 |
0 |
0 |
0.211 |
| 5 |
26 |
|
K |
70 |
15 |
10126 |
◊ |
J |
-x+1,y,-z+1 |
2_656 |
67 |
15 |
10110 |
586.4 |
-4.8 |
0.485 |
9 |
4 |
0 |
0.267 |
27 |
|
N |
70 |
15 |
10116 |
◊ |
N |
-x+1,y,-z+1 |
2_656 |
69 |
15 |
10116 |
579.9 |
-4.6 |
0.500 |
8 |
4 |
0 |
0.267 |
28 |
|
L |
68 |
15 |
10115 |
◊ |
I |
-x+1,y,-z+1 |
2_656 |
68 |
15 |
10110 |
579.5 |
-4.6 |
0.494 |
7 |
4 |
0 |
0.267 |
29 |
|
M |
68 |
15 |
10106 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
68 |
15 |
10117 |
569.7 |
-4.5 |
0.500 |
9 |
4 |
0 |
0.267 |
| Average: |
578.9 |
-4.6 |
0.495 |
8 |
4 |
0 |
0.267 |
| 6 |
30 |
|
T |
49 |
12 |
12866 |
◊ |
C |
x,y,z |
1_555 |
53 |
21 |
12186 |
489.3 |
-2.9 |
0.228 |
4 |
2 |
0 |
0.079 |
31 |
|
U |
48 |
12 |
12853 |
◊ |
D |
x,y,z |
1_555 |
52 |
20 |
12189 |
480.2 |
-2.7 |
0.229 |
4 |
2 |
0 |
0.079 |
32 |
|
R |
47 |
12 |
12848 |
◊ |
A |
x,y,z |
1_555 |
52 |
20 |
12203 |
477.7 |
-2.9 |
0.224 |
4 |
2 |
0 |
0.079 |
33 |
|
S |
49 |
12 |
12872 |
◊ |
B |
x,y,z |
1_555 |
52 |
20 |
12187 |
477.0 |
-2.9 |
0.237 |
4 |
2 |
0 |
0.079 |
34 |
|
Q |
46 |
12 |
12870 |
◊ |
G |
x,y,z |
1_555 |
52 |
21 |
12181 |
471.5 |
-2.9 |
0.216 |
4 |
2 |
0 |
0.079 |
35 |
|
P |
49 |
12 |
12858 |
◊ |
F |
x,y,z |
1_555 |
50 |
20 |
12187 |
470.8 |
-2.8 |
0.237 |
4 |
2 |
0 |
0.079 |
36 |
|
O |
47 |
12 |
12866 |
◊ |
E |
x,y,z |
1_555 |
48 |
19 |
12184 |
463.3 |
-2.6 |
0.225 |
4 |
2 |
0 |
0.079 |
| Average: |
475.7 |
-2.8 |
0.228 |
4 |
2 |
0 |
0.079 |
| 7 |
37 |
|
L |
47 |
14 |
10115 |
◊ |
E |
x,y,z |
1_555 |
50 |
15 |
12184 |
473.4 |
-2.5 |
0.488 |
6 |
3 |
0 |
0.147 |
38 |
|
M |
47 |
14 |
10106 |
◊ |
F |
x,y,z |
1_555 |
47 |
14 |
12187 |
471.5 |
-2.3 |
0.499 |
6 |
3 |
0 |
0.147 |
39 |
|
K |
47 |
14 |
10126 |
◊ |
D |
x,y,z |
1_555 |
47 |
14 |
12189 |
469.7 |
-2.4 |
0.491 |
6 |
3 |
0 |
0.147 |
40 |
|
N |
46 |
14 |
10116 |
◊ |
G |
x,y,z |
1_555 |
48 |
14 |
12181 |
469.5 |
-2.6 |
0.475 |
6 |
3 |
0 |
0.147 |
41 |
|
H |
44 |
13 |
10117 |
◊ |
A |
x,y,z |
1_555 |
47 |
14 |
12203 |
464.0 |
-2.5 |
0.474 |
6 |
3 |
0 |
0.147 |
42 |
|
I |
46 |
14 |
10110 |
◊ |
B |
x,y,z |
1_555 |
47 |
14 |
12187 |
463.2 |
-2.3 |
0.495 |
6 |
3 |
0 |
0.147 |
43 |
|
J |
46 |
14 |
10110 |
◊ |
C |
x,y,z |
1_555 |
47 |
14 |
12186 |
460.7 |
-2.4 |
0.488 |
6 |
3 |
0 |
0.147 |
| Average: |
467.4 |
-2.4 |
0.487 |
6 |
3 |
0 |
0.147 |
| 8 |
44 |
|
I |
36 |
9 |
10110 |
◊ |
C |
x,y,z |
1_555 |
54 |
17 |
12186 |
460.9 |
-3.1 |
0.362 |
6 |
6 |
0 |
0.193 |
45 |
|
J |
37 |
9 |
10110 |
◊ |
D |
x,y,z |
1_555 |
53 |
16 |
12189 |
460.1 |
-3.3 |
0.356 |
7 |
6 |
0 |
0.193 |
46 |
|
K |
38 |
9 |
10126 |
◊ |
E |
x,y,z |
1_555 |
54 |
15 |
12184 |
460.0 |
-3.3 |
0.364 |
7 |
6 |
0 |
0.193 |
47 |
|
N |
37 |
9 |
10116 |
◊ |
A |
x,y,z |
1_555 |
52 |
16 |
12203 |
458.9 |
-3.1 |
0.365 |
7 |
6 |
0 |
0.193 |
48 |
|
M |
37 |
9 |
10106 |
◊ |
G |
x,y,z |
1_555 |
54 |
16 |
12181 |
457.6 |
-3.3 |
0.358 |
8 |
6 |
0 |
0.193 |
49 |
|
H |
37 |
9 |
10117 |
◊ |
B |
x,y,z |
1_555 |
52 |
16 |
12187 |
456.1 |
-3.4 |
0.341 |
7 |
6 |
0 |
0.193 |
50 |
|
L |
37 |
9 |
10115 |
◊ |
F |
x,y,z |
1_555 |
51 |
15 |
12187 |
452.8 |
-3.3 |
0.352 |
8 |
5 |
0 |
0.193 |
| Average: |
458.1 |
-3.2 |
0.357 |
7 |
6 |
0 |
0.193 |
| 9 |
51 |
|
U |
32 |
5 |
12853 |
◊ |
E |
x,y,z |
1_555 |
31 |
11 |
12184 |
348.6 |
-3.2 |
0.333 |
6 |
1 |
0 |
0.094 |
52 |
|
O |
32 |
5 |
12866 |
◊ |
F |
x,y,z |
1_555 |
32 |
12 |
12187 |
348.4 |
-3.1 |
0.348 |
6 |
1 |
0 |
0.094 |
53 |
|
T |
31 |
5 |
12866 |
◊ |
D |
x,y,z |
1_555 |
34 |
12 |
12189 |
342.2 |
-3.1 |
0.346 |
6 |
1 |
0 |
0.094 |
54 |
|
S |
31 |
5 |
12872 |
◊ |
C |
x,y,z |
1_555 |
31 |
11 |
12186 |
342.2 |
-2.9 |
0.357 |
6 |
1 |
0 |
0.094 |
55 |
|
P |
32 |
5 |
12858 |
◊ |
G |
x,y,z |
1_555 |
33 |
11 |
12181 |
339.9 |
-2.9 |
0.371 |
6 |
1 |
0 |
0.094 |
56 |
|
R |
32 |
6 |
12848 |
◊ |
B |
x,y,z |
1_555 |
34 |
12 |
12187 |
338.0 |
-3.2 |
0.343 |
6 |
1 |
0 |
0.094 |
57 |
|
Q |
33 |
6 |
12870 |
◊ |
A |
x,y,z |
1_555 |
30 |
12 |
12203 |
336.0 |
-2.9 |
0.358 |
6 |
1 |
0 |
0.094 |
| Average: |
342.2 |
-3.0 |
0.351 |
6 |
1 |
0 |
0.094 |
| 10 |
58 |
|
E |
30 |
12 |
12184 |
◊ |
M |
-x+1/2,y-1/2,-z+1 |
4_546 |
37 |
13 |
10106 |
312.8 |
1.4 |
0.734 |
2 |
1 |
0 |
0.000 |
| 11 |
59 |
|
U |
26 |
8 |
12853 |
◊ |
R |
-x+1/2,y-1/2,-z |
4_545 |
22 |
6 |
12848 |
182.5 |
-1.1 |
0.582 |
2 |
0 |
0 |
0.000 |
60 |
|
T |
21 |
5 |
12866 |
◊ |
S |
-x+1/2,y-1/2,-z |
4_545 |
23 |
7 |
12872 |
170.3 |
-1.1 |
0.575 |
1 |
0 |
0 |
0.000 |
| Average: |
176.4 |
-1.1 |
0.579 |
2 |
0 |
0 |
0.000 |
| 12 |
61 |
|
U |
11 |
4 |
12853 |
◊ |
S |
-x+1/2,y-1/2,-z |
4_545 |
12 |
4 |
12872 |
109.6 |
0.6 |
0.754 |
2 |
0 |
0 |
0.000 |
| 13 |
62 |
|
U |
13 |
7 |
12853 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
12 |
3 |
12203 |
96.4 |
-1.4 |
0.394 |
0 |
0 |
0 |
0.000 |
63 |
|
C |
12 |
3 |
12186 |
◊ |
S |
-x+1/2,y-1/2,-z |
4_545 |
12 |
6 |
12872 |
96.2 |
-1.3 |
0.403 |
0 |
0 |
0 |
0.000 |
| Average: |
96.3 |
-1.4 |
0.398 |
0 |
0 |
0 |
0.000 |
| 14 |
64 |
|
E |
8 |
3 |
12184 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
10 |
4 |
12187 |
85.2 |
0.9 |
0.757 |
0 |
0 |
0 |
0.000 |
| 15 |
65 |
|
E |
8 |
4 |
12184 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
11 |
4 |
12181 |
80.4 |
1.0 |
0.760 |
2 |
0 |
0 |
0.000 |
| 16 |
66 |
|
F |
5 |
1 |
12187 |
◊ |
M |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
1 |
10106 |
66.7 |
0.6 |
0.765 |
0 |
0 |
0 |
0.000 |
| 17 |
67 |
|
Q |
2 |
1 |
12870 |
◊ |
F |
x,y,z |
1_555 |
4 |
2 |
12187 |
48.0 |
-1.3 |
0.114 |
0 |
0 |
0 |
0.019 |
68 |
|
R |
2 |
1 |
12848 |
◊ |
G |
x,y,z |
1_555 |
4 |
2 |
12181 |
47.7 |
-1.2 |
0.120 |
0 |
0 |
0 |
0.019 |
69 |
|
P |
2 |
1 |
12858 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
12184 |
45.4 |
-1.2 |
0.134 |
0 |
0 |
0 |
0.019 |
70 |
|
T |
2 |
1 |
12866 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
12187 |
44.8 |
-1.2 |
0.135 |
0 |
0 |
0 |
0.019 |
71 |
|
S |
2 |
1 |
12872 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12203 |
44.2 |
-1.1 |
0.125 |
0 |
0 |
0 |
0.019 |
72 |
|
U |
2 |
1 |
12853 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
12186 |
43.8 |
-1.1 |
0.123 |
0 |
0 |
0 |
0.019 |
73 |
|
O |
2 |
1 |
12866 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
12189 |
43.7 |
-1.2 |
0.132 |
0 |
0 |
0 |
0.019 |
| Average: |
45.4 |
-1.2 |
0.126 |
0 |
0 |
0 |
0.019 |
| 18 |
74 |
|
K |
5 |
2 |
10126 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
7 |
4 |
12187 |
41.7 |
1.1 |
0.841 |
0 |
0 |
0 |
0.000 |
| 19 |
75 |
|
L |
3 |
2 |
10115 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
2 |
12181 |
23.4 |
-0.1 |
0.510 |
0 |
0 |
0 |
0.000 |
| 20 |
76 |
|
U |
2 |
1 |
12853 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
2 |
1 |
12187 |
10.3 |
0.2 |
0.734 |
0 |
0 |
0 |
0.000 |
|