## |
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 |
|
B |
135 |
37 |
22227 |
◊ |
A |
x,y,z |
1_555 |
126 |
39 |
23542 |
1170.5 |
3.4 |
0.767 |
14 |
6 |
0 |
0.000 |
2 |
|
A |
129 |
35 |
23542 |
◊ |
B |
x-1,y,z |
1_455 |
125 |
40 |
22227 |
1112.4 |
2.2 |
0.709 |
13 |
6 |
0 |
0.000 |
Average: |
1141.5 |
2.8 |
0.738 |
14 |
6 |
0 |
0.000 |
2 |
3 |
|
A |
58 |
18 |
23542 |
◊ |
B |
x,y,z-1 |
1_554 |
56 |
19 |
22227 |
598.1 |
-2.1 |
0.381 |
6 |
4 |
0 |
0.000 |
3 |
4 |
|
[59F]A:601 |
37 |
1 |
748 |
cf |
A |
x,y,z |
1_555 |
75 |
26 |
23542 |
518.1 |
-1.0 |
0.403 |
14 |
0 |
0 |
0.018 |
5 |
|
[59F]B:601 |
36 |
1 |
749 |
cf |
B |
x,y,z |
1_555 |
76 |
25 |
22227 |
514.9 |
-0.9 |
0.414 |
14 |
0 |
0 |
0.018 |
Average: |
516.5 |
-0.9 |
0.408 |
14 |
0 |
0 |
0.018 |
4 |
6 |
|
B |
38 |
10 |
22227 |
x |
B |
x,y-1,z+1 |
1_546 |
52 |
12 |
22227 |
418.8 |
-0.5 |
0.469 |
5 |
4 |
0 |
0.000 |
7 |
|
A |
50 |
12 |
23542 |
x |
A |
x,y-1,z+1 |
1_546 |
38 |
10 |
23542 |
414.6 |
0.1 |
0.541 |
6 |
4 |
0 |
0.000 |
Average: |
416.7 |
-0.2 |
0.505 |
6 |
4 |
0 |
0.000 |
5 |
8 |
|
[GOL]B:602 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
22227 |
142.8 |
-0.4 |
0.535 |
6 |
0 |
0 |
0.007 |
9 |
|
[GOL]A:602 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
23542 |
140.0 |
-0.1 |
0.529 |
6 |
0 |
0 |
0.007 |
Average: |
141.4 |
-0.2 |
0.532 |
6 |
0 |
0 |
0.007 |
6 |
10 |
|
[GOL]B:603 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
22227 |
121.9 |
-0.2 |
0.558 |
4 |
0 |
0 |
0.005 |
7 |
11 |
|
[GOL]B:604 |
6 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
22227 |
107.5 |
-0.2 |
0.536 |
2 |
0 |
0 |
0.000 |
8 |
12 |
|
[GOL]A:603 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
23542 |
105.2 |
-0.6 |
0.460 |
3 |
0 |
0 |
0.005 |
9 |
13 |
|
[GOL]A:604 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
23542 |
102.1 |
-0.3 |
0.551 |
2 |
0 |
0 |
0.003 |
10 |
14 |
|
A |
10 |
4 |
23542 |
f |
[GOL]B:604 |
x-1,y,z |
1_455 |
5 |
1 |
221 |
72.2 |
-0.7 |
0.436 |
1 |
0 |
0 |
0.003 |
11 |
15 |
|
[CL]B:606 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
22227 |
72.1 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.024 |
16 |
|
[CL]A:607 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
23542 |
70.3 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.024 |
Average: |
71.2 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.024 |
12 |
17 |
|
[CL]B:605 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
22227 |
67.0 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.024 |
13 |
18 |
|
[CL]A:606 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
23542 |
65.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.023 |
14 |
19 |
|
[CL]B:607 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
22227 |
65.7 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.022 |
15 |
20 |
|
[GOL]A:603 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
22227 |
62.4 |
0.2 |
0.570 |
1 |
0 |
0 |
0.000 |
16 |
21 |
|
[CL]A:605 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
23542 |
56.9 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.019 |
17 |
22 |
|
[CL]A:605 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
22227 |
40.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
[GOL]B:603 |
3 |
1 |
220 |
◊ |
[GOL]A:603 |
x,y,z |
1_555 |
3 |
1 |
222 |
31.8 |
0.2 |
0.575 |
1 |
0 |
0 |
0.000 |
19 |
24 |
|
[GOL]B:603 |
4 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
23542 |
30.2 |
0.6 |
0.659 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
B |
4 |
2 |
22227 |
x |
B |
x,y,z-1 |
1_554 |
2 |
2 |
22227 |
15.0 |
0.7 |
0.825 |
0 |
0 |
0 |
0.000 |
|