| ## |
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 |
176 |
50 |
13250 |
◊ |
B |
x,y,z |
1_555 |
176 |
47 |
13130 |
1624.0 |
-19.4 |
0.050 |
16 |
0 |
0 |
1.000 |
2 |
|
D |
173 |
47 |
13132 |
◊ |
A |
x,y,z |
1_555 |
171 |
48 |
13251 |
1623.8 |
-18.2 |
0.068 |
16 |
2 |
0 |
1.000 |
| Average: |
1623.9 |
-18.8 |
0.059 |
16 |
1 |
0 |
1.000 |
| 2 |
3 |
|
D |
106 |
27 |
13132 |
◊ |
B |
x,y,z |
1_555 |
102 |
25 |
13130 |
1106.5 |
-14.3 |
0.052 |
8 |
10 |
0 |
1.000 |
4 |
|
C |
103 |
25 |
13250 |
◊ |
A |
x,y,z |
1_555 |
101 |
25 |
13251 |
1089.2 |
-14.3 |
0.049 |
8 |
10 |
0 |
1.000 |
| Average: |
1097.8 |
-14.3 |
0.051 |
8 |
10 |
0 |
1.000 |
| 3 |
5 |
|
C |
44 |
17 |
13250 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
35 |
11 |
13132 |
371.8 |
1.5 |
0.754 |
4 |
6 |
0 |
0.000 |
| 4 |
6 |
|
A |
29 |
9 |
13251 |
◊ |
B |
x-1,y,z |
1_455 |
34 |
12 |
13130 |
308.9 |
3.5 |
0.866 |
4 |
4 |
0 |
0.000 |
| 5 |
7 |
|
D |
32 |
15 |
13132 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
23 |
7 |
13250 |
251.9 |
0.9 |
0.717 |
5 |
2 |
0 |
0.000 |
| 6 |
8 |
|
[RSH]B:1295 |
11 |
1 |
314 |
cf |
B |
x,y,z |
1_555 |
18 |
12 |
13130 |
136.7 |
2.0 |
0.504 |
4 |
0 |
0 |
0.000 |
9 |
|
[RSH]D:1295 |
11 |
1 |
313 |
cf |
D |
x,y,z |
1_555 |
22 |
12 |
13132 |
133.6 |
1.9 |
0.525 |
4 |
0 |
0 |
0.000 |
| Average: |
135.1 |
1.9 |
0.515 |
4 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[RSH]C:1295 |
11 |
1 |
308 |
cf |
C |
x,y,z |
1_555 |
21 |
13 |
13250 |
131.1 |
1.7 |
0.498 |
8 |
0 |
0 |
0.221 |
11 |
|
[RSH]A:1295 |
11 |
1 |
311 |
cf |
A |
x,y,z |
1_555 |
21 |
13 |
13251 |
130.9 |
1.5 |
0.546 |
5 |
0 |
0 |
0.221 |
| Average: |
131.0 |
1.6 |
0.522 |
7 |
0 |
0 |
0.221 |
| 8 |
12 |
|
B |
13 |
5 |
13130 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
18 |
6 |
13250 |
120.9 |
0.9 |
0.710 |
0 |
1 |
0 |
0.000 |
| 9 |
13 |
|
[GOL]D:1298 |
6 |
1 |
227 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
13132 |
100.6 |
-0.1 |
0.546 |
5 |
0 |
0 |
0.156 |
| 10 |
14 |
|
[3GR]A:1297 |
6 |
1 |
225 |
f |
A |
x,y,z |
1_555 |
19 |
13 |
13251 |
97.0 |
2.2 |
0.426 |
4 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[GOL]C:1298 |
6 |
1 |
227 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
13250 |
96.7 |
-0.1 |
0.551 |
6 |
0 |
0 |
0.493 |
16 |
|
[GOL]B:1298 |
6 |
1 |
225 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
13130 |
96.2 |
-0.1 |
0.559 |
6 |
0 |
0 |
0.493 |
17 |
|
[GOL]A:1298 |
6 |
1 |
225 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
13251 |
96.0 |
-0.2 |
0.547 |
6 |
0 |
0 |
0.493 |
| Average: |
96.3 |
-0.1 |
0.552 |
6 |
0 |
0 |
0.493 |
| 12 |
18 |
|
[3GR]C:1297 |
6 |
1 |
223 |
f |
C |
x,y,z |
1_555 |
21 |
13 |
13250 |
93.8 |
2.0 |
0.429 |
4 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[3GR]B:1297 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
20 |
13 |
13130 |
91.9 |
2.1 |
0.431 |
3 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[3GR]D:1297 |
6 |
1 |
223 |
◊ |
D |
x,y,z |
1_555 |
21 |
12 |
13132 |
91.7 |
2.2 |
0.417 |
3 |
0 |
0 |
0.000 |
| 15 |
21 |
|
[GOL]C:1298 |
6 |
1 |
227 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
13130 |
86.7 |
-0.9 |
0.449 |
1 |
0 |
0 |
0.161 |
22 |
|
[GOL]B:1298 |
6 |
1 |
225 |
◊ |
C |
x,y,z |
1_555 |
12 |
6 |
13250 |
84.9 |
-0.9 |
0.419 |
2 |
0 |
0 |
0.161 |
23 |
|
[GOL]A:1298 |
6 |
1 |
225 |
◊ |
D |
x,y,z |
1_555 |
11 |
6 |
13132 |
84.6 |
-1.0 |
0.390 |
1 |
0 |
0 |
0.161 |
| Average: |
85.4 |
-1.0 |
0.419 |
1 |
0 |
0 |
0.161 |
| 16 |
24 |
|
[GOL]D:1298 |
6 |
1 |
227 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
13251 |
83.0 |
-0.9 |
0.381 |
0 |
0 |
0 |
0.058 |
| 17 |
25 |
|
[PYR]D:1296 |
5 |
1 |
206 |
cf |
D |
x,y,z |
1_555 |
15 |
9 |
13132 |
74.1 |
3.1 |
0.528 |
3 |
0 |
0 |
0.000 |
26 |
|
[PYR]C:1296 |
5 |
1 |
203 |
cf |
C |
x,y,z |
1_555 |
14 |
9 |
13250 |
67.4 |
2.8 |
0.527 |
3 |
0 |
0 |
0.000 |
27 |
|
[PYR]A:1296 |
5 |
1 |
203 |
cf |
A |
x,y,z |
1_555 |
14 |
9 |
13251 |
65.9 |
2.7 |
0.522 |
3 |
0 |
0 |
0.000 |
| Average: |
69.1 |
2.9 |
0.526 |
3 |
0 |
0 |
0.000 |
| 18 |
28 |
|
[PYR]B:1296 |
5 |
1 |
208 |
cf |
B |
x,y,z |
1_555 |
12 |
9 |
13130 |
67.7 |
2.8 |
0.638 |
3 |
0 |
0 |
0.000 |
| 19 |
29 |
|
[3GR]A:1297 |
6 |
1 |
225 |
f |
[RSH]A:1295 |
x,y,z |
1_555 |
8 |
1 |
311 |
67.4 |
1.7 |
0.548 |
0 |
0 |
0 |
0.000 |
| 20 |
30 |
|
[3GR]C:1297 |
6 |
1 |
223 |
f |
[RSH]C:1295 |
x,y,z |
1_555 |
6 |
1 |
308 |
65.5 |
1.4 |
0.092 |
0 |
0 |
0 |
0.000 |
| 21 |
31 |
|
[3GR]B:1297 |
6 |
1 |
222 |
◊ |
[RSH]B:1295 |
x,y,z |
1_555 |
9 |
1 |
314 |
65.4 |
2.4 |
0.131 |
0 |
0 |
0 |
0.000 |
| 22 |
32 |
|
A |
9 |
4 |
13251 |
◊ |
C |
-x-1/2,-y+1,z-1/2 |
2_464 |
8 |
3 |
13250 |
64.6 |
1.8 |
0.854 |
0 |
0 |
0 |
0.000 |
| 23 |
33 |
|
[3GR]D:1297 |
6 |
1 |
223 |
◊ |
[RSH]D:1295 |
x,y,z |
1_555 |
8 |
1 |
313 |
64.1 |
2.2 |
0.128 |
0 |
0 |
0 |
0.000 |
| 24 |
34 |
|
[PYR]D:1296 |
5 |
1 |
206 |
f |
[RSH]D:1295 |
x,y,z |
1_555 |
5 |
1 |
313 |
62.8 |
3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[PYR]B:1296 |
5 |
1 |
208 |
f |
[RSH]B:1295 |
x,y,z |
1_555 |
6 |
1 |
314 |
61.0 |
3.0 |
0.206 |
0 |
0 |
0 |
0.000 |
| Average: |
61.9 |
3.0 |
0.103 |
0 |
0 |
0 |
0.000 |
| 25 |
36 |
|
[PYR]C:1296 |
5 |
1 |
203 |
f |
[RSH]C:1295 |
x,y,z |
1_555 |
9 |
1 |
308 |
61.9 |
3.1 |
0.188 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
[PYR]A:1296 |
5 |
1 |
203 |
f |
[RSH]A:1295 |
x,y,z |
1_555 |
8 |
1 |
311 |
57.9 |
2.9 |
0.206 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
D |
6 |
5 |
13132 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
3 |
13130 |
32.5 |
0.4 |
0.716 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
[3GR]A:1297 |
5 |
1 |
225 |
f |
[PYR]A:1296 |
x,y,z |
1_555 |
4 |
1 |
203 |
32.3 |
1.7 |
1.000 |
0 |
0 |
0 |
0.000 |
| 29 |
40 |
|
[3GR]C:1297 |
5 |
1 |
223 |
f |
[PYR]C:1296 |
x,y,z |
1_555 |
4 |
1 |
203 |
31.6 |
1.7 |
1.000 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
[3GR]D:1297 |
5 |
1 |
223 |
◊ |
[PYR]D:1296 |
x,y,z |
1_555 |
4 |
1 |
206 |
29.8 |
1.8 |
1.000 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[3GR]B:1297 |
5 |
1 |
222 |
◊ |
[PYR]B:1296 |
x,y,z |
1_555 |
4 |
1 |
208 |
29.3 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
| 32 |
43 |
|
C |
5 |
2 |
13250 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
2 |
13251 |
24.5 |
0.7 |
0.771 |
0 |
0 |
0 |
0.000 |
| 33 |
44 |
|
[3GR]D:1297 |
2 |
1 |
223 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
13251 |
8.3 |
-0.1 |
0.599 |
0 |
0 |
0 |
0.004 |
| 34 |
45 |
|
[3GR]B:1297 |
2 |
1 |
222 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
13250 |
8.3 |
-0.1 |
0.597 |
0 |
0 |
0 |
0.005 |
| 35 |
46 |
|
[RSH]B:1295 |
2 |
1 |
314 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
13250 |
7.6 |
0.0 |
0.337 |
0 |
0 |
0 |
0.000 |
47 |
|
[RSH]D:1295 |
2 |
1 |
313 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13251 |
4.8 |
0.0 |
0.299 |
0 |
0 |
0 |
0.000 |
| Average: |
6.2 |
0.0 |
0.318 |
0 |
0 |
0 |
0.000 |
| 36 |
48 |
|
[RSH]A:1295 |
1 |
1 |
311 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
13132 |
1.7 |
0.0 |
0.371 |
0 |
0 |
0 |
0.000 |
|