## |
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 |
157 |
51 |
29018 |
◊ |
A |
x,y,z |
1_555 |
155 |
51 |
29304 |
1497.7 |
-16.5 |
0.140 |
14 |
7 |
0 |
0.925 |
2 |
|
C |
157 |
52 |
24403 |
◊ |
B |
x,y,z |
1_555 |
143 |
48 |
24178 |
1380.2 |
-14.3 |
0.166 |
13 |
4 |
0 |
0.925 |
Average: |
1438.9 |
-15.4 |
0.153 |
14 |
6 |
0 |
0.925 |
2 |
3 |
|
B |
98 |
25 |
24178 |
◊ |
A |
x,y,z |
1_555 |
66 |
19 |
29304 |
763.8 |
-13.0 |
0.017 |
2 |
0 |
0 |
0.274 |
4 |
|
D |
31 |
9 |
29018 |
◊ |
C |
x,y,z |
1_555 |
38 |
12 |
24403 |
383.4 |
-8.2 |
0.010 |
1 |
0 |
0 |
0.274 |
Average: |
573.6 |
-10.6 |
0.013 |
2 |
0 |
0 |
0.274 |
3 |
5 |
|
A |
88 |
29 |
29304 |
◊ |
D |
x-1,y,z |
1_455 |
71 |
25 |
29018 |
669.1 |
2.2 |
0.820 |
4 |
6 |
0 |
0.000 |
4 |
6 |
|
D |
49 |
15 |
29018 |
◊ |
B |
x,y,z |
1_555 |
56 |
17 |
24178 |
480.6 |
-7.2 |
0.142 |
1 |
1 |
0 |
0.180 |
7 |
|
C |
39 |
13 |
24403 |
◊ |
A |
x,y,z |
1_555 |
44 |
15 |
29304 |
381.3 |
-7.1 |
0.098 |
0 |
0 |
0 |
0.180 |
Average: |
431.0 |
-7.1 |
0.120 |
1 |
1 |
0 |
0.180 |
5 |
8 |
|
A |
25 |
10 |
29304 |
◊ |
C |
x-1,y,z |
1_455 |
29 |
11 |
24403 |
261.6 |
2.5 |
0.877 |
2 |
2 |
0 |
0.000 |
6 |
9 |
|
[BTI]A:2100 |
15 |
1 |
396 |
◊ |
B |
x,y,z |
1_555 |
38 |
17 |
24178 |
256.0 |
4.6 |
0.455 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
D |
30 |
10 |
29018 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
25 |
7 |
24403 |
241.5 |
2.9 |
0.887 |
5 |
0 |
0 |
0.000 |
8 |
11 |
|
D |
27 |
8 |
29018 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
27 |
7 |
24403 |
236.7 |
3.7 |
0.930 |
5 |
1 |
0 |
0.000 |
9 |
12 |
|
A |
19 |
4 |
29304 |
◊ |
B |
x-1,y,z-1 |
1_454 |
19 |
3 |
24178 |
204.1 |
1.7 |
0.841 |
4 |
3 |
0 |
0.000 |
10 |
13 |
|
D |
16 |
8 |
29018 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
23 |
7 |
29304 |
166.6 |
1.2 |
0.766 |
1 |
0 |
0 |
0.000 |
11 |
14 |
|
D |
18 |
6 |
29018 |
◊ |
B |
x,y,z-1 |
1_554 |
20 |
6 |
24178 |
162.0 |
-1.4 |
0.431 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
[PYR]C:2000 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
21 |
13 |
24403 |
134.0 |
5.8 |
0.564 |
2 |
0 |
0 |
0.000 |
16 |
|
[PYR]D:2000 |
6 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
21 |
13 |
29018 |
133.2 |
5.8 |
0.659 |
3 |
0 |
0 |
0.000 |
17 |
|
[PYR]A:2000 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
18 |
12 |
29304 |
131.3 |
6.0 |
0.663 |
4 |
0 |
0 |
0.000 |
Average: |
132.8 |
5.9 |
0.629 |
3 |
0 |
0 |
0.000 |
13 |
18 |
|
[PYR]B:2000 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
21 |
13 |
24178 |
115.9 |
5.1 |
0.657 |
6 |
0 |
0 |
0.000 |
14 |
19 |
|
B |
13 |
6 |
24178 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
19 |
7 |
24403 |
99.0 |
0.2 |
0.687 |
1 |
0 |
0 |
0.000 |
15 |
20 |
|
A |
10 |
4 |
29304 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
3 |
24178 |
87.7 |
1.5 |
0.864 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
[MN]A:2001 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
29304 |
56.4 |
-5.4 |
0.000 |
0 |
0 |
0 |
1.000 |
22 |
|
[MN]D:2001 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
29018 |
55.8 |
-5.3 |
0.000 |
0 |
0 |
0 |
1.000 |
23 |
|
[MN]C:2001 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
6 |
4 |
24403 |
55.0 |
-5.3 |
0.000 |
0 |
0 |
0 |
1.000 |
24 |
|
[MN]B:2001 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
24178 |
53.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
1.000 |
Average: |
55.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
1.000 |
17 |
25 |
|
[BTI]A:2100 |
5 |
1 |
396 |
cf |
A |
x,y,z |
1_555 |
5 |
2 |
29304 |
54.2 |
1.2 |
0.267 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[BTI]A:2100 |
3 |
1 |
396 |
◊ |
[PYR]B:2000 |
x,y,z |
1_555 |
5 |
1 |
218 |
33.9 |
1.9 |
0.633 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
2 |
1 |
29304 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
2 |
1 |
24403 |
26.0 |
0.1 |
0.560 |
0 |
1 |
0 |
0.000 |
20 |
28 |
|
[PYR]B:2000 |
3 |
1 |
218 |
f |
[MN]B:2001 |
x,y,z |
1_555 |
1 |
1 |
123 |
21.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.100 |
29 |
|
[PYR]D:2000 |
1 |
1 |
216 |
f |
[MN]D:2001 |
x,y,z |
1_555 |
1 |
1 |
123 |
18.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.100 |
30 |
|
[PYR]C:2000 |
2 |
1 |
218 |
f |
[MN]C:2001 |
x,y,z |
1_555 |
1 |
1 |
123 |
18.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.100 |
31 |
|
[PYR]A:2000 |
1 |
1 |
214 |
f |
[MN]A:2001 |
x,y,z |
1_555 |
1 |
1 |
123 |
15.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
18.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.100 |
21 |
32 |
|
D |
2 |
2 |
29018 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
3 |
2 |
24178 |
9.3 |
-0.3 |
0.399 |
0 |
0 |
0 |
0.000 |
22 |
33 |
|
D |
1 |
1 |
29018 |
◊ |
C |
-x+1,y-1/2,-z-1 |
2_644 |
1 |
1 |
24403 |
6.5 |
0.3 |
0.861 |
0 |
0 |
0 |
0.000 |
|