## |
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 |
89 |
28 |
10196 |
◊ |
B |
x,y,z |
1_555 |
86 |
27 |
10964 |
866.2 |
0.8 |
0.747 |
13 |
14 |
0 |
0.000 |
2 |
|
C |
83 |
27 |
10891 |
◊ |
A |
x,y,z |
1_555 |
81 |
24 |
10495 |
847.5 |
-0.8 |
0.643 |
11 |
12 |
0 |
0.000 |
Average: |
856.9 |
0.0 |
0.695 |
12 |
13 |
0 |
0.000 |
2 |
3 |
|
B |
63 |
18 |
10964 |
◊ |
C |
-x,y-1/2,-z+1/2 |
4_545 |
60 |
21 |
10891 |
578.3 |
1.0 |
0.714 |
14 |
6 |
0 |
0.000 |
3 |
4 |
|
D |
55 |
16 |
10196 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
61 |
18 |
10964 |
550.0 |
-0.1 |
0.672 |
9 |
6 |
0 |
0.000 |
5 |
|
A |
55 |
16 |
10495 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
56 |
18 |
10891 |
547.5 |
-1.5 |
0.574 |
5 |
3 |
0 |
0.000 |
Average: |
548.7 |
-0.8 |
0.623 |
7 |
5 |
0 |
0.000 |
4 |
6 |
|
D |
61 |
17 |
10196 |
◊ |
C |
x,y,z |
1_555 |
63 |
16 |
10891 |
482.5 |
-2.0 |
0.556 |
5 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
43 |
12 |
10964 |
◊ |
A |
x,y-1,z |
1_545 |
48 |
12 |
10495 |
411.6 |
-3.9 |
0.338 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
27 |
11 |
10964 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
4_645 |
29 |
8 |
10891 |
250.5 |
-2.1 |
0.372 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
[3AB]D:1202 |
10 |
1 |
293 |
f |
D |
x,y,z |
1_555 |
33 |
9 |
10196 |
194.5 |
5.1 |
0.414 |
2 |
0 |
0 |
0.000 |
10 |
|
[3AB]C:1201 |
10 |
1 |
294 |
f |
C |
x,y,z |
1_555 |
30 |
9 |
10891 |
189.5 |
4.9 |
0.400 |
3 |
0 |
0 |
0.000 |
11 |
|
[3AB]B:1202 |
10 |
1 |
293 |
f |
B |
x,y,z |
1_555 |
32 |
9 |
10964 |
185.0 |
4.7 |
0.402 |
3 |
0 |
0 |
0.000 |
12 |
|
[3AB]A:1202 |
10 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
32 |
9 |
10495 |
183.5 |
4.7 |
0.439 |
3 |
0 |
0 |
0.000 |
Average: |
188.1 |
4.8 |
0.414 |
3 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
17 |
3 |
10495 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
24 |
8 |
10196 |
194.1 |
-1.1 |
0.465 |
0 |
3 |
0 |
0.000 |
9 |
14 |
|
[DMS]B:1205 |
4 |
1 |
206 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
10964 |
138.5 |
2.5 |
0.426 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
[GOL]D:1203 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
24 |
11 |
10196 |
132.0 |
-1.2 |
0.447 |
5 |
0 |
0 |
0.000 |
11 |
16 |
|
[DMS]C:1204 |
4 |
1 |
206 |
◊ |
C |
x,y,z |
1_555 |
25 |
10 |
10891 |
130.6 |
3.0 |
0.476 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
B |
12 |
4 |
10964 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
16 |
7 |
10495 |
130.5 |
0.7 |
0.715 |
2 |
2 |
0 |
0.000 |
13 |
18 |
|
D |
11 |
3 |
10196 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
17 |
5 |
10495 |
117.1 |
-2.2 |
0.270 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[GOL]B:1203 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
10964 |
115.4 |
-0.9 |
0.444 |
2 |
0 |
0 |
0.000 |
15 |
20 |
|
[GOL]A:1203 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
10495 |
112.9 |
-1.0 |
0.483 |
2 |
0 |
0 |
0.000 |
16 |
21 |
|
[EDO]B:1206 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
10964 |
109.0 |
1.9 |
0.341 |
3 |
0 |
0 |
0.000 |
17 |
22 |
|
[GOL]C:1203 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
10891 |
105.1 |
-0.8 |
0.503 |
2 |
0 |
0 |
0.000 |
18 |
23 |
|
[EDO]A:1204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
10495 |
101.5 |
2.7 |
0.468 |
2 |
0 |
0 |
0.000 |
19 |
24 |
|
[EDO]B:1207 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
15 |
8 |
10964 |
101.1 |
3.5 |
0.504 |
1 |
0 |
0 |
0.000 |
20 |
25 |
|
[IPA]B:1204 |
4 |
1 |
197 |
◊ |
B |
x,y,z |
1_555 |
23 |
7 |
10964 |
99.1 |
3.1 |
0.439 |
1 |
0 |
0 |
0.000 |
21 |
26 |
|
[DMS]A:1205 |
4 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10495 |
91.0 |
0.6 |
0.215 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[EDO]D:1204 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
10196 |
89.5 |
2.7 |
0.479 |
5 |
0 |
0 |
0.000 |
23 |
28 |
|
A |
11 |
6 |
10495 |
x |
A |
x-1/2,-y+3/2,-z |
3_465 |
5 |
2 |
10495 |
70.6 |
-0.4 |
0.204 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
[IPA]B:1204 |
3 |
1 |
197 |
f |
C |
-x,y-1/2,-z+1/2 |
4_545 |
11 |
5 |
10891 |
58.1 |
1.2 |
0.174 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[EDO]D:1204 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
10891 |
56.4 |
1.4 |
0.842 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
D |
5 |
1 |
10196 |
x |
D |
x-1/2,-y+1/2,-z |
3_455 |
5 |
2 |
10196 |
50.1 |
-0.5 |
0.450 |
1 |
0 |
0 |
0.000 |
27 |
32 |
|
[GOL]A:1203 |
5 |
1 |
217 |
f |
[3AB]A:1202 |
x,y,z |
1_555 |
3 |
1 |
292 |
40.4 |
0.6 |
0.100 |
1 |
0 |
0 |
0.000 |
28 |
33 |
|
[GOL]B:1203 |
4 |
1 |
221 |
f |
[3AB]B:1202 |
x,y,z |
1_555 |
3 |
1 |
293 |
40.1 |
0.7 |
0.106 |
1 |
0 |
0 |
0.000 |
29 |
34 |
|
[GOL]C:1203 |
3 |
1 |
221 |
f |
[3AB]C:1201 |
x,y,z |
1_555 |
3 |
1 |
294 |
37.8 |
1.0 |
0.122 |
2 |
0 |
0 |
0.000 |
30 |
35 |
|
C |
5 |
2 |
10891 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
3 |
2 |
10196 |
36.3 |
-0.7 |
0.318 |
0 |
0 |
0 |
0.000 |
31 |
36 |
|
B |
7 |
1 |
10964 |
◊ |
[DMS]A:1205 |
x,y-1,z |
1_545 |
1 |
1 |
207 |
31.2 |
0.7 |
0.437 |
0 |
0 |
0 |
0.000 |
32 |
37 |
|
[DMS]A:1205 |
1 |
1 |
207 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
10891 |
30.0 |
1.0 |
0.540 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
[EDO]A:1204 |
4 |
1 |
184 |
f |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
1 |
10891 |
29.7 |
0.7 |
0.702 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
[EDO]B:1207 |
2 |
1 |
185 |
f |
A |
x,y-1,z |
1_545 |
4 |
2 |
10495 |
28.6 |
0.0 |
0.610 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
B |
2 |
1 |
10964 |
◊ |
D |
-x,y-1/2,-z+1/2 |
4_545 |
3 |
1 |
10196 |
28.0 |
0.5 |
0.828 |
0 |
0 |
0 |
0.000 |
36 |
41 |
|
B |
3 |
2 |
10964 |
◊ |
[GOL]C:1203 |
-x+1,y-1/2,-z+1/2 |
4_645 |
2 |
1 |
221 |
23.7 |
0.3 |
0.650 |
0 |
0 |
0 |
0.000 |
37 |
42 |
|
[IPA]B:1204 |
1 |
1 |
197 |
◊ |
[DMS]C:1204 |
-x,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
206 |
6.2 |
0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
B |
1 |
1 |
10964 |
f |
[DMS]C:1204 |
-x,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
206 |
0.7 |
0.0 |
0.423 |
0 |
0 |
0 |
0.000 |
|