## |
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 |
|
C |
125 |
36 |
8278 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
124 |
36 |
8278 |
1234.2 |
-27.8 |
0.227 |
4 |
0 |
0 |
0.703 |
2 |
|
B |
126 |
37 |
8152 |
◊ |
A |
x,y,z |
1_555 |
123 |
40 |
8948 |
1227.4 |
-27.7 |
0.141 |
4 |
0 |
0 |
0.703 |
Average: |
1230.8 |
-27.7 |
0.184 |
4 |
0 |
0 |
0.703 |
2 |
3 |
|
A |
97 |
22 |
8948 |
◊ |
A |
-x,y,-z |
2_555 |
97 |
22 |
8948 |
886.5 |
-12.6 |
0.804 |
8 |
0 |
0 |
0.000 |
3 |
4 |
|
C |
79 |
22 |
8278 |
◊ |
A |
x,y,z |
1_555 |
87 |
21 |
8948 |
730.5 |
-18.7 |
0.205 |
0 |
0 |
0 |
0.377 |
4 |
5 |
|
[PP9]A:207 |
42 |
1 |
774 |
f |
A |
x,y,z |
1_555 |
74 |
22 |
8948 |
512.1 |
-15.5 |
0.859 |
4 |
0 |
0 |
0.349 |
5 |
6 |
|
B |
47 |
14 |
8152 |
◊ |
C |
x-1,y,z |
1_455 |
54 |
11 |
8278 |
379.7 |
-8.4 |
0.433 |
2 |
0 |
0 |
0.204 |
6 |
7 |
|
[OLC]A:203 |
24 |
1 |
720 |
f |
A |
x,y,z |
1_555 |
44 |
12 |
8948 |
324.1 |
-0.3 |
0.561 |
0 |
0 |
0 |
0.006 |
7 |
8 |
|
[OLC]C:204 |
23 |
1 |
688 |
◊ |
C |
x,y,z |
1_555 |
46 |
16 |
8278 |
316.0 |
-0.4 |
0.610 |
1 |
0 |
0 |
0.019 |
8 |
9 |
|
[OLC]B:205 |
25 |
1 |
694 |
f |
B |
x,y,z |
1_555 |
38 |
10 |
8152 |
298.0 |
-0.8 |
0.391 |
0 |
0 |
0 |
0.018 |
9 |
10 |
|
B |
34 |
11 |
8152 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
29 |
4 |
8278 |
288.4 |
-4.3 |
0.595 |
3 |
0 |
0 |
0.000 |
10 |
11 |
|
[OLC]A:201 |
24 |
1 |
703 |
f |
A |
x,y,z |
1_555 |
40 |
14 |
8948 |
285.4 |
-2.7 |
0.402 |
3 |
0 |
0 |
0.082 |
11 |
12 |
|
[OLC]C:202 |
21 |
1 |
708 |
f |
C |
x,y,z |
1_555 |
43 |
9 |
8278 |
273.5 |
-3.0 |
0.470 |
1 |
0 |
0 |
0.162 |
12 |
13 |
|
[Z0P]B:208 |
25 |
1 |
969 |
◊ |
A |
x,y,z |
1_555 |
35 |
12 |
8948 |
269.4 |
-1.6 |
0.515 |
1 |
0 |
0 |
0.028 |
13 |
14 |
|
[Z0P]B:208 |
26 |
1 |
969 |
f |
B |
x,y,z |
1_555 |
33 |
8 |
8152 |
267.8 |
-4.8 |
0.238 |
0 |
0 |
0 |
0.106 |
14 |
15 |
|
[OLC]B:201 |
22 |
1 |
722 |
f |
B |
x,y,z |
1_555 |
34 |
12 |
8152 |
267.4 |
-4.8 |
0.283 |
3 |
0 |
0 |
0.134 |
15 |
16 |
|
[OLC]C:203 |
20 |
1 |
710 |
f |
C |
x,y,z |
1_555 |
31 |
11 |
8278 |
265.8 |
-3.4 |
0.278 |
0 |
0 |
0 |
0.160 |
16 |
17 |
|
[OLC]A:206 |
23 |
1 |
697 |
f |
A |
x,y,z |
1_555 |
29 |
12 |
8948 |
250.4 |
-0.5 |
0.472 |
0 |
0 |
0 |
0.010 |
17 |
18 |
|
[OLC]B:203 |
23 |
1 |
683 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
8152 |
242.5 |
-0.8 |
0.474 |
2 |
0 |
0 |
0.036 |
18 |
19 |
|
[OLC]A:205 |
16 |
1 |
500 |
◊ |
A |
x,y,z |
1_555 |
39 |
10 |
8948 |
238.5 |
3.3 |
0.462 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[OLC]A:202 |
20 |
1 |
675 |
f |
A |
x,y,z |
1_555 |
29 |
8 |
8948 |
235.8 |
-0.6 |
0.553 |
0 |
0 |
0 |
0.011 |
20 |
21 |
|
[OLC]C:201 |
19 |
1 |
696 |
f |
C |
-x+1,y,-z+1 |
2_656 |
32 |
11 |
8278 |
224.3 |
-1.3 |
0.425 |
0 |
0 |
0 |
0.063 |
21 |
22 |
|
B |
29 |
10 |
8152 |
f |
[P4C]C:205 |
x-1,y,z |
1_455 |
22 |
1 |
607 |
218.0 |
-3.5 |
0.265 |
0 |
0 |
0 |
0.077 |
22 |
23 |
|
B |
29 |
9 |
8152 |
f |
[OLC]C:204 |
x-1,y,z |
1_455 |
20 |
1 |
688 |
205.0 |
-3.8 |
0.264 |
0 |
0 |
0 |
0.083 |
23 |
24 |
|
B |
22 |
6 |
8152 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
24 |
9 |
8278 |
204.0 |
-0.4 |
0.911 |
4 |
2 |
0 |
0.000 |
24 |
25 |
|
B |
20 |
7 |
8152 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
21 |
9 |
8948 |
201.1 |
3.0 |
0.979 |
8 |
0 |
0 |
0.000 |
25 |
26 |
|
[OLC]A:204 |
21 |
1 |
705 |
f |
C |
x,y,z |
1_555 |
20 |
7 |
8278 |
193.7 |
-2.4 |
0.339 |
1 |
0 |
0 |
0.136 |
26 |
27 |
|
[OLC]B:206 |
12 |
1 |
369 |
f |
B |
x,y,z |
1_555 |
30 |
7 |
8152 |
185.9 |
-0.4 |
0.424 |
0 |
0 |
0 |
0.009 |
27 |
28 |
|
[P4C]C:205 |
18 |
1 |
607 |
◊ |
C |
x,y,z |
1_555 |
24 |
10 |
8278 |
173.6 |
-1.9 |
0.421 |
0 |
0 |
0 |
0.041 |
28 |
29 |
|
[OLC]B:202 |
19 |
1 |
712 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
8948 |
172.0 |
-0.8 |
0.367 |
0 |
0 |
0 |
0.016 |
29 |
30 |
|
[OLC]B:202 |
17 |
1 |
712 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
8152 |
163.9 |
0.9 |
0.570 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
[OLC]B:207 |
12 |
1 |
369 |
◊ |
B |
x,y,z |
1_555 |
18 |
5 |
8152 |
154.5 |
0.3 |
0.458 |
0 |
0 |
0 |
0.000 |
31 |
32 |
|
[OLC]A:201 |
15 |
1 |
703 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
8278 |
153.1 |
1.2 |
0.385 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
[PP9]A:207 |
17 |
1 |
774 |
◊ |
C |
x,y,z |
1_555 |
19 |
4 |
8278 |
143.6 |
-3.9 |
0.790 |
0 |
0 |
0 |
0.080 |
33 |
34 |
|
B |
13 |
4 |
8152 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
16 |
3 |
8948 |
139.1 |
1.2 |
0.944 |
3 |
3 |
0 |
0.000 |
34 |
35 |
|
[OLC]B:203 |
17 |
1 |
683 |
◊ |
C |
x-1,y,z |
1_455 |
17 |
4 |
8278 |
136.1 |
-0.3 |
0.512 |
1 |
0 |
0 |
0.016 |
35 |
36 |
|
[OLC]A:202 |
14 |
1 |
675 |
f |
[OLC]A:201 |
x,y,z |
1_555 |
15 |
1 |
703 |
134.9 |
2.6 |
0.483 |
0 |
0 |
0 |
0.000 |
36 |
37 |
|
[OLC]C:201 |
11 |
1 |
696 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
8278 |
132.1 |
1.7 |
0.577 |
0 |
0 |
0 |
0.000 |
37 |
38 |
|
[OLC]C:203 |
12 |
1 |
710 |
◊ |
[OLC]C:201 |
x,y,z |
1_555 |
14 |
1 |
696 |
120.5 |
3.7 |
0.494 |
2 |
0 |
0 |
0.000 |
38 |
39 |
|
[OLC]A:204 |
15 |
1 |
705 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
8948 |
117.7 |
1.7 |
0.413 |
0 |
0 |
0 |
0.000 |
39 |
40 |
|
[OLC]B:202 |
13 |
1 |
712 |
◊ |
[OLC]B:201 |
x,y,z |
1_555 |
11 |
1 |
722 |
115.9 |
3.6 |
0.571 |
0 |
0 |
0 |
0.000 |
40 |
41 |
|
[OLC]B:204 |
12 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
11 |
2 |
8152 |
98.3 |
0.1 |
0.253 |
0 |
0 |
0 |
0.000 |
41 |
42 |
|
[OLC]A:202 |
8 |
1 |
675 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
8278 |
93.3 |
-0.7 |
0.464 |
0 |
0 |
0 |
0.014 |
42 |
43 |
|
[OLC]C:203 |
9 |
1 |
710 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
11 |
5 |
8278 |
90.9 |
-1.0 |
0.430 |
0 |
0 |
0 |
0.049 |
43 |
44 |
|
[OLC]C:202 |
12 |
1 |
708 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
8948 |
90.0 |
0.4 |
0.510 |
0 |
0 |
0 |
0.000 |
44 |
45 |
|
[P4C]C:205 |
9 |
1 |
607 |
f |
[OLC]C:204 |
x,y,z |
1_555 |
12 |
1 |
688 |
81.9 |
2.2 |
0.499 |
0 |
0 |
0 |
0.000 |
45 |
46 |
|
[OLC]B:204 |
9 |
1 |
397 |
◊ |
[OLC]A:206 |
x-1,y,z |
1_455 |
10 |
1 |
697 |
80.4 |
3.3 |
0.421 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
[Z0P]B:208 |
9 |
1 |
969 |
◊ |
[OLC]C:202 |
x,y,z |
1_555 |
8 |
1 |
708 |
77.8 |
-0.5 |
0.331 |
0 |
0 |
0 |
0.000 |
47 |
48 |
|
[MOE]C:206 |
5 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
8278 |
73.1 |
-2.4 |
0.896 |
0 |
0 |
0 |
0.089 |
48 |
49 |
|
B |
8 |
2 |
8152 |
◊ |
[OLC]A:204 |
x-1,y,z |
1_455 |
11 |
1 |
705 |
72.3 |
-1.6 |
0.335 |
1 |
0 |
0 |
0.046 |
49 |
50 |
|
[OLC]A:206 |
6 |
1 |
697 |
◊ |
[OLC]A:204 |
x,y,z |
1_555 |
8 |
1 |
705 |
66.8 |
3.7 |
0.678 |
0 |
0 |
0 |
0.000 |
50 |
51 |
|
[OLC]B:203 |
7 |
1 |
683 |
f |
[P4C]C:205 |
x-1,y,z |
1_455 |
8 |
1 |
607 |
66.4 |
-1.9 |
0.237 |
0 |
0 |
0 |
0.041 |
51 |
52 |
|
[MOE]C:206 |
5 |
1 |
221 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
12 |
6 |
8278 |
63.3 |
-1.9 |
0.939 |
0 |
0 |
0 |
0.071 |
52 |
53 |
|
[OLC]C:203 |
7 |
1 |
710 |
f |
[OLC]C:202 |
x,y,z |
1_555 |
8 |
1 |
708 |
61.5 |
1.7 |
0.477 |
1 |
0 |
0 |
0.000 |
53 |
54 |
|
[OLC]B:204 |
7 |
1 |
397 |
◊ |
[OLC]A:204 |
x-1,y,z |
1_455 |
5 |
1 |
705 |
58.3 |
3.4 |
0.509 |
0 |
0 |
0 |
0.000 |
54 |
55 |
|
[Z0P]B:208 |
7 |
1 |
969 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
8278 |
52.4 |
-1.3 |
0.301 |
0 |
0 |
0 |
0.000 |
55 |
56 |
|
[P4C]C:205 |
5 |
1 |
607 |
◊ |
[OLC]C:201 |
-x+1,y,-z+1 |
2_656 |
5 |
1 |
696 |
52.0 |
-1.7 |
0.223 |
0 |
0 |
0 |
0.036 |
56 |
57 |
|
[OLC]A:206 |
8 |
1 |
697 |
f |
[OLC]A:201 |
x,y,z |
1_555 |
4 |
1 |
703 |
49.9 |
-1.0 |
0.282 |
0 |
0 |
0 |
0.020 |
57 |
58 |
|
[OLC]A:205 |
4 |
1 |
500 |
◊ |
[OLC]A:203 |
x,y,z |
1_555 |
3 |
1 |
720 |
44.3 |
0.4 |
0.284 |
0 |
0 |
0 |
0.000 |
58 |
59 |
|
[OLC]A:206 |
4 |
1 |
697 |
f |
[OLC]A:202 |
x,y,z |
1_555 |
4 |
1 |
675 |
44.3 |
-1.4 |
0.280 |
0 |
0 |
0 |
0.029 |
59 |
60 |
|
[OLC]C:201 |
3 |
1 |
696 |
◊ |
[OLC]B:203 |
-x,y,-z+1 |
2_556 |
6 |
1 |
683 |
42.2 |
-1.4 |
0.244 |
0 |
0 |
0 |
0.030 |
60 |
61 |
|
[Z0P]B:208 |
6 |
1 |
969 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
5 |
2 |
8278 |
40.7 |
0.5 |
0.593 |
0 |
0 |
0 |
0.000 |
61 |
62 |
|
[OLC]B:207 |
2 |
1 |
369 |
f |
A |
x-1/2,y+1/2,z |
3_455 |
3 |
1 |
8948 |
34.3 |
0.0 |
0.522 |
1 |
0 |
0 |
0.008 |
62 |
63 |
|
[Z0P]B:208 |
4 |
1 |
969 |
f |
[OLC]B:205 |
x,y,z |
1_555 |
2 |
1 |
694 |
34.2 |
-1.1 |
0.295 |
0 |
0 |
0 |
0.024 |
63 |
64 |
|
[OLC]A:205 |
2 |
1 |
500 |
◊ |
[OLC]A:205 |
-x,y,-z |
2_555 |
2 |
1 |
500 |
31.3 |
2.1 |
0.374 |
0 |
0 |
0 |
0.000 |
64 |
65 |
|
[MOE]C:206 |
2 |
1 |
221 |
f |
[MOE]C:206 |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
221 |
29.5 |
-3.0 |
0.836 |
0 |
0 |
0 |
0.100 |
65 |
66 |
|
[OLC]B:206 |
4 |
1 |
369 |
f |
[OLC]B:203 |
x,y,z |
1_555 |
2 |
1 |
683 |
26.6 |
0.0 |
0.338 |
0 |
0 |
0 |
0.000 |
66 |
67 |
|
[OLC]B:203 |
3 |
1 |
683 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
8278 |
23.0 |
-1.2 |
0.182 |
0 |
0 |
0 |
0.000 |
67 |
68 |
|
C |
2 |
1 |
8278 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
8152 |
20.7 |
1.4 |
0.980 |
0 |
0 |
0 |
0.000 |
68 |
69 |
|
[OLC]A:205 |
3 |
1 |
500 |
f |
A |
-x,y,-z |
2_555 |
4 |
2 |
8948 |
18.7 |
0.2 |
0.361 |
0 |
0 |
0 |
0.000 |
69 |
70 |
|
B |
1 |
1 |
8152 |
◊ |
A |
-x,y,-z |
2_555 |
1 |
1 |
8948 |
16.0 |
0.3 |
0.437 |
0 |
0 |
0 |
0.000 |
70 |
71 |
|
[OLC]B:206 |
1 |
1 |
369 |
f |
[OLC]B:205 |
x,y,z |
1_555 |
3 |
1 |
694 |
12.7 |
0.2 |
0.425 |
0 |
0 |
0 |
0.000 |
71 |
72 |
|
B |
3 |
2 |
8152 |
◊ |
[OLC]A:201 |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
703 |
11.0 |
0.4 |
0.610 |
0 |
0 |
0 |
0.000 |
72 |
73 |
|
B |
2 |
1 |
8152 |
◊ |
[OLC]A:202 |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
675 |
6.1 |
-0.2 |
0.547 |
0 |
0 |
0 |
0.000 |
73 |
74 |
|
C |
1 |
1 |
8278 |
x |
C |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
8278 |
4.2 |
0.1 |
0.846 |
0 |
0 |
0 |
0.000 |
|