## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
378 |
62 |
211080 |
◊ |
D |
x,y,z |
1_555 |
294 |
80 |
12443 |
3144.9 |
-51.3 |
0.836 |
84 |
0 |
0 |
0.156 |
2 |
|
A |
348 |
70 |
211080 |
◊ |
L |
x,y,z |
1_555 |
274 |
72 |
9194 |
2930.5 |
-57.8 |
0.761 |
71 |
0 |
0 |
0.147 |
3 |
|
A |
328 |
62 |
211080 |
◊ |
I |
x,y,z |
1_555 |
255 |
59 |
8437 |
2831.1 |
-55.9 |
0.720 |
57 |
0 |
0 |
0.153 |
4 |
|
A |
315 |
59 |
211080 |
◊ |
Q |
x,y,z |
1_555 |
226 |
53 |
7477 |
2491.2 |
-41.3 |
0.866 |
49 |
0 |
0 |
0.144 |
5 |
|
A |
288 |
58 |
211080 |
◊ |
T |
x,y,z |
1_555 |
228 |
61 |
7167 |
2488.6 |
-53.7 |
0.527 |
46 |
0 |
0 |
0.150 |
6 |
|
A |
297 |
55 |
211080 |
◊ |
P |
x,y,z |
1_555 |
247 |
56 |
5574 |
2455.4 |
-46.8 |
0.566 |
44 |
0 |
0 |
0.145 |
7 |
|
A |
258 |
48 |
211080 |
◊ |
G |
x,y,z |
1_555 |
178 |
46 |
10383 |
1996.2 |
-24.7 |
0.914 |
35 |
0 |
0 |
0.165 |
8 |
|
A |
247 |
45 |
211080 |
◊ |
H |
x,y,z |
1_555 |
191 |
50 |
8288 |
1952.0 |
-27.1 |
0.590 |
31 |
0 |
0 |
0.167 |
9 |
|
A |
208 |
37 |
211080 |
◊ |
M |
x,y,z |
1_555 |
189 |
50 |
8293 |
1906.6 |
-46.1 |
0.449 |
49 |
0 |
0 |
0.146 |
10 |
|
A |
255 |
48 |
211080 |
◊ |
N |
x,y,z |
1_555 |
172 |
37 |
5518 |
1895.0 |
-32.7 |
0.885 |
48 |
0 |
0 |
0.156 |
11 |
|
A |
239 |
42 |
211080 |
◊ |
E |
x,y,z |
1_555 |
181 |
54 |
8212 |
1867.3 |
-34.6 |
0.755 |
47 |
0 |
0 |
0.133 |
12 |
|
A |
248 |
44 |
211080 |
◊ |
J |
x,y,z |
1_555 |
168 |
43 |
7384 |
1863.4 |
-30.8 |
0.816 |
32 |
0 |
0 |
0.142 |
13 |
|
A |
218 |
41 |
211080 |
◊ |
K |
x,y,z |
1_555 |
181 |
43 |
7176 |
1846.5 |
-36.3 |
0.696 |
37 |
0 |
0 |
0.144 |
14 |
|
A |
199 |
38 |
211080 |
◊ |
O |
x,y,z |
1_555 |
180 |
43 |
6286 |
1713.8 |
-31.6 |
0.798 |
34 |
0 |
0 |
0.147 |
15 |
|
A |
201 |
39 |
211080 |
◊ |
C |
x,y,z |
1_555 |
158 |
40 |
11614 |
1642.3 |
-28.8 |
0.855 |
23 |
0 |
0 |
0.160 |
16 |
|
A |
202 |
38 |
211080 |
◊ |
S |
x,y,z |
1_555 |
168 |
30 |
5782 |
1569.2 |
-20.9 |
0.925 |
26 |
0 |
0 |
0.133 |
17 |
|
A |
146 |
34 |
211080 |
◊ |
U |
x,y,z |
1_555 |
116 |
22 |
2409 |
1295.8 |
-32.4 |
0.300 |
33 |
0 |
0 |
0.139 |
18 |
|
A |
147 |
29 |
211080 |
x |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
152 |
29 |
211080 |
1114.7 |
-30.8 |
0.935 |
11 |
0 |
0 |
0.000 |
19 |
|
R |
101 |
23 |
5358 |
◊ |
F |
x,y,z |
1_555 |
106 |
26 |
6781 |
1000.6 |
-7.5 |
0.122 |
11 |
2 |
0 |
0.052 |
20 |
|
A |
121 |
25 |
211080 |
◊ |
B |
x,y,z |
1_555 |
88 |
30 |
11967 |
964.8 |
-14.6 |
0.841 |
19 |
0 |
0 |
0.094 |
21 |
|
A |
99 |
20 |
211080 |
◊ |
R |
x,y,z |
1_555 |
82 |
22 |
5358 |
866.0 |
-21.0 |
0.411 |
19 |
0 |
0 |
0.120 |
22 |
|
N |
86 |
20 |
5518 |
◊ |
C |
x,y,z |
1_555 |
97 |
24 |
11614 |
819.8 |
-6.3 |
0.343 |
5 |
0 |
0 |
0.025 |
23 |
|
N |
85 |
18 |
5518 |
◊ |
J |
x,y,z |
1_555 |
81 |
18 |
7384 |
781.3 |
-9.1 |
0.214 |
8 |
6 |
0 |
0.681 |
24 |
|
J |
71 |
18 |
7384 |
◊ |
J |
-y,-x,-z-1/2 |
8_554 |
72 |
18 |
7384 |
694.3 |
-10.0 |
0.149 |
6 |
0 |
0 |
0.319 |
25 |
|
H |
53 |
16 |
8288 |
◊ |
E |
x,y,z |
1_555 |
66 |
18 |
8212 |
577.3 |
-2.1 |
0.410 |
6 |
5 |
0 |
0.013 |
26 |
|
A |
66 |
13 |
211080 |
◊ |
F |
x,y,z |
1_555 |
67 |
18 |
6781 |
541.0 |
-7.1 |
0.765 |
10 |
0 |
0 |
0.047 |
27 |
|
E |
47 |
14 |
8212 |
◊ |
D |
x,y,z |
1_555 |
38 |
11 |
12443 |
399.6 |
0.5 |
0.546 |
3 |
2 |
0 |
0.002 |
28 |
|
S |
39 |
10 |
5782 |
◊ |
M |
x,y,z |
1_555 |
38 |
12 |
8293 |
348.5 |
-4.6 |
0.314 |
1 |
0 |
0 |
0.000 |
29 |
|
[4OC]A:1402 |
22 |
1 |
489 |
cf |
A |
x,y,z |
1_555 |
55 |
11 |
211080 |
337.7 |
3.4 |
0.832 |
4 |
0 |
0 |
0.000 |
30 |
|
J |
37 |
13 |
7384 |
◊ |
C |
x,y,z |
1_555 |
38 |
10 |
11614 |
336.9 |
-4.9 |
0.199 |
2 |
0 |
0 |
0.018 |
31 |
|
M |
34 |
11 |
8293 |
◊ |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
42 |
9 |
211080 |
321.6 |
-6.4 |
0.480 |
3 |
0 |
0 |
0.000 |
32 |
|
[UR3]A:1498 |
21 |
1 |
451 |
cf |
A |
x,y,z |
1_555 |
51 |
10 |
211080 |
310.1 |
-1.9 |
0.749 |
6 |
0 |
0 |
0.019 |
33 |
|
[2MG]A:1207 |
24 |
1 |
503 |
cf |
A |
x,y,z |
1_555 |
47 |
5 |
211080 |
303.6 |
3.0 |
0.910 |
3 |
0 |
0 |
0.000 |
34 |
|
[MA6]A:1519 |
23 |
1 |
519 |
cf |
A |
x,y,z |
1_555 |
52 |
9 |
211080 |
303.4 |
1.9 |
0.644 |
1 |
0 |
0 |
0.000 |
35 |
|
[MA6]A:1518 |
24 |
1 |
514 |
cf |
A |
x,y,z |
1_555 |
49 |
8 |
211080 |
298.4 |
2.5 |
0.645 |
1 |
0 |
0 |
0.000 |
36 |
|
R |
38 |
8 |
5358 |
◊ |
K |
x,y,z |
1_555 |
35 |
11 |
7176 |
294.0 |
-2.0 |
0.487 |
3 |
1 |
0 |
0.009 |
37 |
|
[7MG]A:527 |
24 |
1 |
508 |
cf |
A |
x,y,z |
1_555 |
42 |
9 |
211080 |
284.4 |
1.8 |
0.847 |
5 |
0 |
0 |
0.002 |
38 |
|
I |
24 |
8 |
8437 |
◊ |
G |
x,y,z |
1_555 |
27 |
10 |
10383 |
278.3 |
-2.5 |
0.286 |
2 |
0 |
0 |
0.000 |
39 |
|
[5MC]A:1404 |
21 |
1 |
446 |
cf |
A |
x,y,z |
1_555 |
41 |
6 |
211080 |
272.6 |
0.9 |
0.886 |
5 |
0 |
0 |
0.006 |
40 |
|
[PSU]A:516 |
20 |
1 |
425 |
cf |
A |
x,y,z |
1_555 |
42 |
6 |
211080 |
270.2 |
-1.6 |
0.755 |
2 |
0 |
0 |
0.010 |
41 |
|
F |
30 |
10 |
6781 |
◊ |
B |
-y,-x,-z+1/2 |
8_555 |
29 |
7 |
11967 |
268.3 |
-0.2 |
0.571 |
2 |
3 |
0 |
0.000 |
42 |
|
C |
30 |
12 |
11614 |
◊ |
C |
-y,-x,-z-1/2 |
8_554 |
30 |
12 |
11614 |
265.1 |
0.3 |
0.701 |
0 |
0 |
0 |
0.000 |
43 |
|
H |
24 |
8 |
8288 |
◊ |
B |
x,y,z |
1_555 |
36 |
9 |
11967 |
256.6 |
-1.4 |
0.399 |
3 |
1 |
0 |
0.012 |
44 |
|
[5MC]A:1407 |
21 |
1 |
448 |
cf |
A |
x,y,z |
1_555 |
31 |
5 |
211080 |
238.4 |
0.3 |
0.886 |
3 |
0 |
0 |
0.004 |
45 |
|
K |
28 |
8 |
7176 |
◊ |
G |
x,y,z |
1_555 |
31 |
7 |
10383 |
227.2 |
-2.5 |
0.361 |
2 |
0 |
0 |
0.009 |
46 |
|
[PSU]A:1540 |
18 |
1 |
433 |
cf |
A |
x,y,z |
1_555 |
29 |
7 |
211080 |
221.7 |
-3.2 |
0.678 |
1 |
0 |
0 |
0.015 |
47 |
|
Q |
24 |
4 |
7477 |
◊ |
L |
x,y,z |
1_555 |
21 |
6 |
9194 |
197.0 |
-3.7 |
0.190 |
0 |
0 |
0 |
0.006 |
48 |
|
[5MC]A:967 |
17 |
1 |
451 |
cf |
A |
x,y,z |
1_555 |
26 |
5 |
211080 |
181.5 |
-0.8 |
0.649 |
0 |
0 |
0 |
0.003 |
49 |
|
[5MC]A:1400 |
14 |
1 |
456 |
cf |
A |
x,y,z |
1_555 |
22 |
4 |
211080 |
167.8 |
0.4 |
0.828 |
0 |
0 |
0 |
0.000 |
50 |
|
[PSU]A:1541 |
14 |
1 |
435 |
cf |
A |
x,y,z |
1_555 |
24 |
6 |
211080 |
165.3 |
-4.0 |
0.587 |
1 |
0 |
0 |
0.018 |
51 |
|
J |
25 |
7 |
7384 |
◊ |
I |
x,y,z |
1_555 |
18 |
4 |
8437 |
162.4 |
-1.1 |
0.385 |
1 |
0 |
0 |
0.002 |
52 |
|
[5MC]A:967 |
17 |
1 |
451 |
cf |
[M2G]A:966 |
x,y,z |
1_555 |
20 |
1 |
529 |
148.1 |
0.2 |
0.759 |
0 |
0 |
0 |
0.000 |
53 |
|
D |
12 |
5 |
12443 |
◊ |
D |
-y,-x,-z-1/2 |
8_554 |
12 |
5 |
12443 |
139.6 |
1.7 |
0.730 |
2 |
6 |
0 |
0.000 |
54 |
|
[MA6]A:1519 |
18 |
1 |
519 |
cf |
[MA6]A:1518 |
x,y,z |
1_555 |
19 |
1 |
514 |
130.1 |
3.5 |
0.436 |
0 |
0 |
0 |
0.000 |
55 |
|
[PSU]A:1541 |
15 |
1 |
435 |
cf |
[PSU]A:1540 |
x,y,z |
1_555 |
17 |
1 |
433 |
128.5 |
-0.0 |
0.669 |
0 |
0 |
0 |
0.000 |
56 |
|
R |
13 |
5 |
5358 |
◊ |
R |
-y,-x,-z+1/2 |
8_555 |
13 |
5 |
5358 |
126.5 |
-0.5 |
0.537 |
1 |
0 |
0 |
0.000 |
57 |
|
Q |
16 |
5 |
7477 |
◊ |
H |
x,y,z |
1_555 |
15 |
4 |
8288 |
125.0 |
0.8 |
0.683 |
2 |
0 |
0 |
0.000 |
58 |
|
[M2G]A:966 |
9 |
1 |
529 |
cf |
A |
x,y,z |
1_555 |
16 |
4 |
211080 |
101.7 |
-0.6 |
0.753 |
0 |
0 |
0 |
0.003 |
59 |
|
A |
11 |
3 |
211080 |
◊ |
F |
-y,-x,-z+1/2 |
8_555 |
8 |
4 |
6781 |
98.9 |
-0.4 |
0.715 |
2 |
0 |
0 |
0.000 |
60 |
|
E |
8 |
3 |
8212 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
11614 |
69.6 |
-0.2 |
0.599 |
1 |
1 |
0 |
0.002 |
61 |
|
I |
8 |
2 |
8437 |
◊ |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
9 |
2 |
211080 |
69.0 |
-1.8 |
0.528 |
1 |
0 |
0 |
0.000 |
62 |
|
[5MC]A:967 |
6 |
1 |
451 |
◊ |
I |
x,y,z |
1_555 |
8 |
1 |
8437 |
68.0 |
0.3 |
0.633 |
1 |
0 |
0 |
0.000 |
63 |
|
G |
9 |
3 |
10383 |
◊ |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
8 |
2 |
211080 |
67.4 |
-3.1 |
0.326 |
0 |
0 |
0 |
0.000 |
64 |
|
[5MC]A:1400 |
11 |
1 |
456 |
◊ |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
9 |
1 |
211080 |
66.7 |
0.2 |
0.742 |
0 |
0 |
0 |
0.000 |
65 |
|
[7MG]A:527 |
3 |
1 |
508 |
◊ |
L |
x,y,z |
1_555 |
9 |
5 |
9194 |
65.9 |
-0.8 |
0.465 |
1 |
0 |
0 |
0.002 |
66 |
|
N |
12 |
1 |
5518 |
◊ |
I |
x,y,z |
1_555 |
7 |
1 |
8437 |
61.3 |
-0.4 |
0.505 |
0 |
0 |
0 |
0.000 |
67 |
|
R |
5 |
2 |
5358 |
◊ |
F |
-y,-x,-z+1/2 |
8_555 |
9 |
3 |
6781 |
56.2 |
0.8 |
0.728 |
1 |
0 |
0 |
0.000 |
68 |
|
[M2G]A:966 |
6 |
1 |
529 |
◊ |
I |
x,y,z |
1_555 |
6 |
1 |
8437 |
55.3 |
-1.9 |
0.434 |
0 |
0 |
0 |
0.003 |
69 |
|
L |
6 |
2 |
9194 |
◊ |
H |
x,y,z |
1_555 |
7 |
2 |
8288 |
55.1 |
-0.9 |
0.333 |
0 |
0 |
0 |
0.000 |
70 |
|
[MA6]A:1519 |
6 |
1 |
519 |
f |
[5MC]A:1404 |
x,y,z |
1_555 |
4 |
1 |
446 |
46.0 |
-2.2 |
0.261 |
0 |
0 |
0 |
0.009 |
71 |
|
[MA6]A:1519 |
3 |
1 |
519 |
f |
[UR3]A:1498 |
x,y,z |
1_555 |
7 |
1 |
451 |
42.9 |
1.9 |
0.732 |
0 |
0 |
0 |
0.000 |
72 |
|
A |
6 |
3 |
211080 |
◊ |
B |
-y,-x,-z-1/2 |
8_554 |
4 |
3 |
11967 |
34.1 |
-1.0 |
0.592 |
0 |
0 |
0 |
0.000 |
73 |
|
O |
2 |
1 |
6286 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
6781 |
33.5 |
0.3 |
0.357 |
0 |
0 |
0 |
0.000 |
74 |
|
[UR3]A:1498 |
6 |
1 |
451 |
f |
[5MC]A:1404 |
x,y,z |
1_555 |
6 |
1 |
446 |
31.8 |
0.2 |
0.645 |
0 |
0 |
0 |
0.000 |
75 |
|
J |
2 |
1 |
7384 |
◊ |
C |
-y,-x,-z-1/2 |
8_554 |
2 |
2 |
11614 |
27.8 |
-0.9 |
0.164 |
0 |
0 |
0 |
0.000 |
76 |
|
[UR3]A:1498 |
2 |
1 |
451 |
f |
[4OC]A:1402 |
x,y,z |
1_555 |
1 |
1 |
489 |
25.1 |
0.6 |
0.660 |
0 |
0 |
0 |
0.000 |
77 |
|
U |
4 |
3 |
2409 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
8293 |
23.9 |
0.3 |
0.402 |
0 |
0 |
0 |
0.000 |
78 |
|
[MA6]A:1518 |
3 |
1 |
514 |
f |
[UR3]A:1498 |
x,y,z |
1_555 |
4 |
1 |
451 |
22.5 |
1.1 |
0.602 |
0 |
0 |
0 |
0.000 |
79 |
|
Q |
6 |
3 |
7477 |
◊ |
O |
x,y,z |
1_555 |
1 |
1 |
6286 |
19.9 |
-0.1 |
0.664 |
0 |
0 |
0 |
0.000 |
80 |
|
[ZN]N:101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
211080 |
16.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.025 |
81 |
|
[2MG]A:1207 |
3 |
1 |
503 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
11614 |
13.1 |
0.3 |
0.677 |
0 |
0 |
0 |
0.000 |
82 |
|
[5MC]A:1400 |
2 |
1 |
456 |
f |
[M2G]A:966 |
x,y,z |
1_555 |
3 |
1 |
529 |
12.5 |
0.2 |
0.501 |
0 |
0 |
0 |
0.000 |
83 |
|
S |
1 |
1 |
5782 |
◊ |
N |
x,y,z |
1_555 |
3 |
2 |
5518 |
5.0 |
0.1 |
0.731 |
0 |
0 |
0 |
0.000 |
84 |
|
[PSU]A:1541 |
1 |
1 |
435 |
◊ |
A |
-y-1/2,x-1/2,z+1/4 |
2_445 |
1 |
1 |
211080 |
2.9 |
-0.1 |
0.483 |
0 |
0 |
0 |
0.000 |
85 |
|
E |
1 |
1 |
8212 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11967 |
0.3 |
0.0 |
0.668 |
0 |
0 |
0 |
0.000 |
|