| ## |
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 |
|
D |
60 |
20 |
6232 |
◊ |
A |
x,y,z |
1_555 |
57 |
19 |
6302 |
552.7 |
-0.2 |
0.605 |
8 |
0 |
0 |
0.065 |
2 |
|
C |
59 |
19 |
6262 |
◊ |
B |
x,y,z |
1_555 |
55 |
19 |
6331 |
532.6 |
-0.4 |
0.545 |
8 |
0 |
0 |
0.065 |
| Average: |
542.7 |
-0.3 |
0.575 |
8 |
0 |
0 |
0.065 |
| 2 |
3 |
|
B |
57 |
16 |
6331 |
◊ |
A |
x,y,z |
1_555 |
46 |
14 |
6302 |
489.4 |
1.0 |
0.628 |
3 |
0 |
0 |
0.000 |
4 |
|
D |
51 |
17 |
6232 |
◊ |
C |
x,y,z |
1_555 |
51 |
15 |
6262 |
428.4 |
-0.9 |
0.472 |
4 |
0 |
0 |
0.000 |
| Average: |
458.9 |
0.0 |
0.550 |
4 |
0 |
0 |
0.000 |
| 3 |
5 |
|
D |
35 |
11 |
6232 |
◊ |
B |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
38 |
11 |
6331 |
345.3 |
-2.4 |
0.284 |
1 |
0 |
0 |
0.061 |
| 4 |
6 |
|
B |
39 |
11 |
6331 |
◊ |
C |
x-1,y,z |
1_455 |
43 |
14 |
6262 |
336.8 |
0.2 |
0.560 |
2 |
1 |
0 |
0.000 |
| 5 |
7 |
|
A |
38 |
12 |
6302 |
◊ |
B |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
34 |
12 |
6331 |
324.4 |
-0.1 |
0.548 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
D |
29 |
10 |
6232 |
◊ |
C |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
31 |
11 |
6262 |
284.5 |
-0.3 |
0.553 |
2 |
0 |
0 |
0.010 |
| 7 |
9 |
|
D |
27 |
11 |
6232 |
◊ |
B |
y,x,-z |
7_555 |
25 |
8 |
6331 |
200.1 |
-0.3 |
0.524 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
24 |
9 |
6302 |
◊ |
D |
x-1,y,z |
1_455 |
26 |
9 |
6232 |
165.0 |
-1.5 |
0.393 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
C |
18 |
8 |
6262 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
6302 |
153.2 |
0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[TEW]B:201 |
20 |
1 |
535 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
6331 |
146.2 |
-3.4 |
0.822 |
0 |
0 |
0 |
0.029 |
| 11 |
13 |
|
[TEW]B:205 |
13 |
1 |
537 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
6331 |
141.5 |
-3.8 |
0.695 |
1 |
0 |
0 |
0.091 |
| 12 |
14 |
|
D |
19 |
5 |
6232 |
◊ |
[TEW]B:202 |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
16 |
1 |
537 |
135.2 |
-3.3 |
0.626 |
1 |
0 |
0 |
0.080 |
| 13 |
15 |
|
[TEW]A:202 |
17 |
1 |
534 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
6302 |
133.9 |
-2.3 |
0.627 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
C |
13 |
4 |
6262 |
◊ |
C |
y,x,-z |
7_555 |
13 |
4 |
6262 |
132.3 |
1.1 |
0.754 |
1 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[TEW]D:201 |
17 |
1 |
533 |
◊ |
D |
x,y,z |
1_555 |
21 |
7 |
6232 |
128.6 |
-1.9 |
0.744 |
0 |
0 |
0 |
0.016 |
| 16 |
18 |
|
A |
14 |
5 |
6302 |
◊ |
A |
y,x,-z |
7_555 |
14 |
5 |
6302 |
127.5 |
2.7 |
0.881 |
3 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[TEW]A:201 |
16 |
1 |
536 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
6302 |
127.4 |
-6.1 |
0.598 |
0 |
0 |
0 |
0.052 |
| 18 |
20 |
|
[TEW]B:203 |
16 |
1 |
538 |
◊ |
B |
x,y,z |
1_555 |
18 |
5 |
6331 |
122.9 |
-1.6 |
0.723 |
0 |
0 |
0 |
0.000 |
| 19 |
21 |
|
B |
17 |
4 |
6331 |
◊ |
D |
x-1,y,z |
1_455 |
14 |
4 |
6232 |
112.7 |
-0.5 |
0.466 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[ACT]D:203 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
19 |
8 |
6232 |
112.4 |
-0.5 |
0.635 |
0 |
0 |
0 |
0.011 |
| 21 |
23 |
|
[TEW]B:204 |
11 |
1 |
536 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
6302 |
109.7 |
-0.4 |
0.783 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
D |
14 |
4 |
6232 |
◊ |
C |
x,y-1,z |
1_545 |
15 |
4 |
6262 |
109.0 |
-0.2 |
0.556 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
13 |
3 |
6302 |
◊ |
B |
x,y-1,z |
1_545 |
14 |
3 |
6331 |
99.7 |
-0.0 |
0.563 |
0 |
0 |
0 |
0.000 |
| Average: |
104.4 |
-0.1 |
0.560 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[TEW]A:201 |
15 |
1 |
536 |
◊ |
B |
y,x,-z |
7_555 |
10 |
3 |
6331 |
105.4 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
A |
14 |
4 |
6302 |
◊ |
[TEW]B:205 |
x,y-1,z |
1_545 |
11 |
1 |
537 |
102.1 |
-0.4 |
0.539 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[TEW]A:201 |
9 |
1 |
536 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
6232 |
100.2 |
-2.9 |
0.641 |
0 |
0 |
0 |
0.025 |
| 26 |
29 |
|
[TEW]D:201 |
10 |
1 |
533 |
cf |
[TEW]B:203 |
x,y-1,z |
1_545 |
11 |
1 |
538 |
97.8 |
-7.5 |
0.621 |
0 |
0 |
0 |
0.063 |
| 27 |
30 |
|
[TEW]D:201 |
8 |
1 |
533 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
6302 |
97.0 |
-4.2 |
0.442 |
0 |
0 |
0 |
0.036 |
| 28 |
31 |
|
[TEW]B:204 |
14 |
1 |
536 |
f |
D |
x-1,y,z |
1_455 |
16 |
5 |
6232 |
95.6 |
-2.5 |
0.797 |
0 |
0 |
0 |
0.053 |
| 29 |
32 |
|
[TEW]B:202 |
9 |
1 |
537 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
6331 |
95.0 |
-5.1 |
0.408 |
0 |
0 |
0 |
0.110 |
| 30 |
33 |
|
[TEW]B:203 |
8 |
1 |
538 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
6262 |
93.0 |
-1.2 |
0.625 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[TEW]A:202 |
12 |
1 |
534 |
◊ |
B |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
6 |
3 |
6331 |
91.0 |
-1.6 |
0.844 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[TEW]B:204 |
12 |
1 |
536 |
f |
[TEW]B:205 |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
11 |
1 |
537 |
89.2 |
-7.4 |
0.640 |
0 |
0 |
0 |
0.158 |
| 33 |
36 |
|
[TEW]B:201 |
10 |
1 |
535 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
6262 |
88.4 |
-4.8 |
0.460 |
0 |
0 |
0 |
0.041 |
| 34 |
37 |
|
[TEW]A:202 |
16 |
1 |
534 |
◊ |
C |
x-1,y-1,z |
1_445 |
10 |
2 |
6262 |
83.2 |
-0.5 |
0.848 |
0 |
0 |
0 |
0.004 |
| 35 |
38 |
|
[ACT]A:205 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
6302 |
81.6 |
-0.1 |
0.633 |
0 |
0 |
0 |
0.000 |
| 36 |
39 |
|
[NA]B:207 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
6331 |
73.8 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.219 |
| 37 |
40 |
|
[TEW]B:204 |
7 |
1 |
536 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
6331 |
71.7 |
-1.7 |
0.508 |
0 |
0 |
0 |
0.000 |
| 38 |
41 |
|
[NA]A:203 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
6302 |
65.7 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.167 |
42 |
|
[NA]C:202 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
6262 |
65.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.167 |
| Average: |
65.5 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.167 |
| 39 |
43 |
|
[NA]D:202 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
6232 |
63.8 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.195 |
| 40 |
44 |
|
[TEW]B:201 |
8 |
1 |
535 |
◊ |
D |
y,x,-z |
7_555 |
8 |
3 |
6232 |
63.3 |
-0.3 |
0.865 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[GOL]A:204 |
5 |
1 |
217 |
f |
[GOL]A:204 |
y,x,-z |
7_555 |
5 |
1 |
217 |
48.7 |
0.4 |
0.705 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
[TEW]A:202 |
6 |
1 |
534 |
f |
A |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
6 |
3 |
6302 |
47.9 |
-2.7 |
0.509 |
0 |
0 |
0 |
0.023 |
| 43 |
47 |
|
B |
5 |
2 |
6331 |
◊ |
C |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
6 |
4 |
6262 |
47.8 |
0.0 |
0.542 |
0 |
0 |
0 |
0.000 |
| 44 |
48 |
|
[GOL]A:204 |
6 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
6302 |
47.7 |
-0.8 |
0.416 |
0 |
0 |
0 |
0.000 |
| 45 |
49 |
|
[TEW]B:204 |
6 |
1 |
536 |
◊ |
B |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
4 |
1 |
6331 |
39.7 |
-1.0 |
0.760 |
0 |
0 |
0 |
0.022 |
| 46 |
50 |
|
[NA]B:206 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
6331 |
33.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.067 |
51 |
|
[NA]B:206 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
6262 |
32.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.067 |
| Average: |
33.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.067 |
| 47 |
52 |
|
[NA]D:202 |
1 |
1 |
125 |
◊ |
B |
y,x,-z |
7_555 |
2 |
2 |
6331 |
31.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 48 |
53 |
|
[GOL]A:204 |
4 |
1 |
217 |
f |
[NA]C:201 |
x,y,z |
1_555 |
1 |
1 |
125 |
23.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.046 |
| 49 |
54 |
|
[GOL]A:204 |
2 |
1 |
217 |
f |
[NA]C:201 |
y,x,-z |
7_555 |
1 |
1 |
125 |
22.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.053 |
| 50 |
55 |
|
[TEW]B:202 |
5 |
1 |
537 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
6262 |
20.1 |
0.1 |
0.875 |
0 |
0 |
0 |
0.000 |
| 51 |
56 |
|
[TEW]D:201 |
2 |
1 |
533 |
◊ |
[TEW]B:202 |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
2 |
1 |
537 |
18.3 |
0.4 |
0.862 |
0 |
0 |
0 |
0.000 |
| 52 |
57 |
|
[ACT]A:205 |
1 |
1 |
183 |
◊ |
A |
y,x,-z |
7_555 |
3 |
1 |
6302 |
17.1 |
-0.1 |
0.608 |
0 |
0 |
0 |
0.000 |
| 53 |
58 |
|
[NA]C:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
6262 |
15.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 54 |
59 |
|
[TEW]B:201 |
2 |
1 |
535 |
◊ |
C |
y,x,-z |
7_555 |
2 |
1 |
6262 |
13.8 |
0.2 |
0.747 |
0 |
0 |
0 |
0.000 |
| 55 |
60 |
|
[TEW]A:201 |
2 |
1 |
536 |
◊ |
A |
y,x,-z |
7_555 |
3 |
1 |
6302 |
13.6 |
-0.7 |
0.541 |
0 |
0 |
0 |
0.000 |
| 56 |
61 |
|
D |
3 |
1 |
6232 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
6331 |
11.9 |
-0.4 |
0.377 |
0 |
0 |
0 |
0.000 |
| 57 |
62 |
|
A |
3 |
2 |
6302 |
f |
[TEW]B:203 |
x,y-1,z |
1_545 |
1 |
1 |
538 |
10.6 |
0.1 |
0.722 |
0 |
0 |
0 |
0.000 |
| 58 |
63 |
|
[NA]B:206 |
1 |
1 |
125 |
◊ |
[TEW]B:202 |
x,y,z |
1_555 |
1 |
1 |
537 |
9.2 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.012 |
| 59 |
64 |
|
[TEW]D:201 |
1 |
1 |
533 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
2 |
6262 |
6.1 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
| 60 |
65 |
|
A |
3 |
3 |
6302 |
◊ |
C |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
4 |
3 |
6262 |
3.2 |
0.0 |
0.614 |
0 |
0 |
0 |
0.000 |
| 61 |
66 |
|
[NA]C:201 |
1 |
1 |
125 |
f |
[NA]C:201 |
y,x,-z |
7_555 |
1 |
1 |
125 |
2.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| 62 |
67 |
|
B |
1 |
1 |
6331 |
◊ |
[TEW]B:205 |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
1 |
1 |
537 |
1.5 |
0.1 |
0.637 |
0 |
0 |
0 |
0.000 |
| 63 |
68 |
|
[TEW]B:204 |
1 |
1 |
536 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
6262 |
1.4 |
-0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
| 64 |
69 |
|
[GOL]A:204 |
1 |
1 |
217 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
6262 |
1.0 |
-0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
| 65 |
70 |
|
[TEW]B:202 |
1 |
1 |
537 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
6232 |
1.0 |
-0.1 |
0.539 |
0 |
0 |
0 |
0.000 |
|