## |
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 |
87 |
28 |
10984 |
◊ |
A |
x,y,z |
1_555 |
91 |
26 |
10490 |
865.3 |
-0.3 |
0.685 |
10 |
10 |
0 |
0.000 |
2 |
|
D |
84 |
27 |
10260 |
◊ |
B |
x,y,z |
1_555 |
84 |
26 |
10846 |
864.8 |
-1.1 |
0.634 |
11 |
10 |
0 |
0.000 |
Average: |
865.0 |
-0.7 |
0.659 |
11 |
10 |
0 |
0.000 |
2 |
3 |
|
B |
69 |
23 |
10846 |
◊ |
C |
-x,y-1/2,-z+1/2 |
4_545 |
64 |
19 |
10984 |
631.7 |
2.1 |
0.808 |
17 |
9 |
0 |
0.000 |
3 |
4 |
|
A |
50 |
14 |
10490 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
57 |
17 |
10984 |
523.6 |
-1.9 |
0.525 |
7 |
3 |
0 |
0.000 |
5 |
|
D |
49 |
13 |
10260 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
54 |
16 |
10846 |
452.3 |
-1.1 |
0.587 |
4 |
0 |
0 |
0.000 |
Average: |
487.9 |
-1.5 |
0.556 |
6 |
2 |
0 |
0.000 |
4 |
6 |
|
D |
57 |
15 |
10260 |
◊ |
C |
x,y,z |
1_555 |
60 |
16 |
10984 |
477.5 |
-1.4 |
0.550 |
6 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
45 |
13 |
10846 |
◊ |
A |
x,y-1,z |
1_545 |
48 |
13 |
10490 |
418.7 |
-3.6 |
0.379 |
1 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
30 |
11 |
10846 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
4_645 |
34 |
9 |
10984 |
254.9 |
-2.4 |
0.403 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
[DRL]B:1202 |
12 |
1 |
336 |
f |
B |
x,y,z |
1_555 |
39 |
12 |
10846 |
222.9 |
-5.5 |
0.419 |
3 |
0 |
0 |
0.287 |
10 |
|
[DRL]D:1202 |
12 |
1 |
336 |
f |
D |
x,y,z |
1_555 |
39 |
13 |
10260 |
222.2 |
-5.9 |
0.383 |
3 |
0 |
0 |
0.287 |
11 |
|
[DRL]A:1202 |
12 |
1 |
333 |
f |
A |
x,y,z |
1_555 |
38 |
12 |
10490 |
222.0 |
-5.5 |
0.411 |
3 |
0 |
0 |
0.287 |
12 |
|
[DRL]C:1202 |
12 |
1 |
335 |
f |
C |
x,y,z |
1_555 |
37 |
12 |
10984 |
219.3 |
-5.6 |
0.391 |
3 |
0 |
0 |
0.287 |
Average: |
221.6 |
-5.6 |
0.401 |
3 |
0 |
0 |
0.287 |
8 |
13 |
|
D |
19 |
3 |
10260 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
23 |
9 |
10490 |
218.5 |
-0.8 |
0.480 |
4 |
1 |
0 |
0.000 |
9 |
14 |
|
A |
16 |
3 |
10490 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
26 |
9 |
10260 |
199.2 |
-0.7 |
0.537 |
1 |
4 |
0 |
0.000 |
10 |
15 |
|
B |
12 |
3 |
10846 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
16 |
7 |
10490 |
134.5 |
0.8 |
0.718 |
2 |
2 |
0 |
0.000 |
11 |
16 |
|
A |
17 |
7 |
10490 |
x |
A |
x-1/2,-y+3/2,-z |
3_465 |
9 |
3 |
10490 |
129.5 |
-0.5 |
0.477 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
[EDO]D:1204 |
4 |
1 |
182 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
27 |
10 |
10846 |
107.1 |
2.8 |
0.473 |
1 |
0 |
0 |
0.000 |
13 |
18 |
|
[EDO]B:1204 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
10846 |
103.5 |
2.6 |
0.453 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
[EDO]C:1203 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
10984 |
100.6 |
2.3 |
0.252 |
2 |
0 |
0 |
0.000 |
15 |
20 |
|
[EDO]C:1205 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
10984 |
91.1 |
2.1 |
0.250 |
5 |
0 |
0 |
0.004 |
16 |
21 |
|
[EDO]B:1203 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10846 |
89.6 |
2.4 |
0.267 |
2 |
0 |
0 |
0.000 |
17 |
22 |
|
[DMS]D:1203 |
4 |
1 |
208 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
10260 |
83.7 |
1.7 |
0.379 |
1 |
0 |
0 |
0.000 |
18 |
23 |
|
[EDO]C:1204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
10490 |
82.7 |
3.7 |
0.335 |
1 |
0 |
0 |
0.000 |
19 |
24 |
|
[EDO]C:1206 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
14 |
4 |
10984 |
81.3 |
1.9 |
0.217 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[EDO]C:1204 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
10984 |
78.3 |
3.8 |
0.346 |
6 |
0 |
0 |
0.000 |
21 |
26 |
|
[EDO]A:1203 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
10490 |
71.4 |
0.6 |
0.399 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
B |
8 |
2 |
10846 |
f |
[EDO]A:1203 |
x,y-1,z |
1_545 |
3 |
1 |
185 |
43.4 |
0.3 |
0.582 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[EDO]D:1204 |
3 |
1 |
182 |
f |
D |
x,y,z |
1_555 |
5 |
1 |
10260 |
37.3 |
1.0 |
0.762 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
C |
5 |
2 |
10984 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
3 |
2 |
10260 |
36.1 |
-0.7 |
0.337 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[EDO]C:1203 |
3 |
1 |
184 |
f |
[DRL]C:1202 |
x,y,z |
1_555 |
2 |
1 |
335 |
35.5 |
-0.0 |
0.712 |
0 |
0 |
0 |
0.002 |
26 |
31 |
|
B |
2 |
1 |
10846 |
◊ |
D |
-x,y-1/2,-z+1/2 |
4_545 |
3 |
1 |
10260 |
30.0 |
0.0 |
0.476 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[EDO]A:1203 |
3 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
10984 |
24.1 |
0.8 |
0.828 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[EDO]B:1203 |
1 |
1 |
184 |
f |
[DRL]B:1202 |
x,y,z |
1_555 |
2 |
1 |
336 |
18.9 |
-0.1 |
0.833 |
0 |
0 |
0 |
0.002 |
29 |
34 |
|
D |
1 |
1 |
10260 |
x |
D |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
10260 |
9.2 |
-0.0 |
0.441 |
0 |
0 |
0 |
0.000 |
30 |
35 |
|
[EDO]C:1206 |
2 |
1 |
183 |
f |
[EDO]C:1205 |
x,y,z |
1_555 |
1 |
1 |
184 |
5.1 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|