## |
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 |
126 |
36 |
26935 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
136 |
40 |
25433 |
1235.1 |
-13.7 |
0.078 |
5 |
2 |
0 |
0.197 |
2 |
2 |
|
C |
103 |
27 |
26935 |
◊ |
B |
-x,y,-z+1 |
2_556 |
134 |
37 |
25433 |
1008.6 |
-11.2 |
0.144 |
4 |
2 |
0 |
0.011 |
3 |
3 |
|
E |
85 |
16 |
1906 |
◊ |
B |
x,y,z |
1_555 |
137 |
37 |
25433 |
938.4 |
-9.3 |
0.303 |
17 |
1 |
0 |
0.896 |
4 |
|
D |
74 |
13 |
1528 |
◊ |
A |
x,y,z |
1_555 |
109 |
30 |
25433 |
796.1 |
-9.7 |
0.355 |
10 |
0 |
0 |
0.896 |
Average: |
867.3 |
-9.5 |
0.329 |
14 |
1 |
0 |
0.896 |
4 |
5 |
|
A |
79 |
29 |
25433 |
◊ |
C |
-x-1/2,y-1/2,-z |
4_445 |
97 |
26 |
26935 |
823.1 |
-7.4 |
0.243 |
8 |
1 |
0 |
0.113 |
5 |
6 |
|
F |
69 |
13 |
1510 |
◊ |
C |
x,y,z |
1_555 |
100 |
25 |
26935 |
750.3 |
-10.5 |
0.297 |
9 |
0 |
0 |
0.340 |
6 |
7 |
|
C |
60 |
17 |
26935 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
60 |
15 |
25433 |
521.4 |
-1.2 |
0.554 |
6 |
9 |
0 |
0.000 |
7 |
8 |
|
A |
51 |
15 |
25433 |
◊ |
A |
-x,y,-z |
2_555 |
51 |
15 |
25433 |
449.4 |
-3.3 |
0.369 |
8 |
0 |
0 |
0.035 |
8 |
9 |
|
B |
46 |
16 |
25433 |
◊ |
A |
x,y,z |
1_555 |
36 |
15 |
25433 |
345.5 |
3.6 |
0.874 |
7 |
2 |
0 |
0.000 |
9 |
10 |
|
[MAL]C:2201 |
23 |
1 |
458 |
f |
C |
x,y,z |
1_555 |
53 |
20 |
26935 |
318.6 |
1.7 |
0.510 |
9 |
0 |
0 |
0.149 |
11 |
|
[MAL]A:2201 |
23 |
1 |
460 |
f |
A |
x,y,z |
1_555 |
52 |
20 |
25433 |
318.5 |
1.7 |
0.499 |
9 |
0 |
0 |
0.149 |
12 |
|
[MAL]B:2201 |
23 |
1 |
458 |
f |
B |
x,y,z |
1_555 |
50 |
20 |
25433 |
316.3 |
1.6 |
0.479 |
10 |
0 |
0 |
0.149 |
Average: |
317.8 |
1.7 |
0.496 |
9 |
0 |
0 |
0.149 |
10 |
13 |
|
A |
35 |
13 |
25433 |
◊ |
A |
-x,y,-z+1 |
2_556 |
35 |
13 |
25433 |
290.1 |
-3.0 |
0.320 |
2 |
2 |
0 |
0.000 |
11 |
14 |
|
A |
23 |
8 |
25433 |
◊ |
B |
x,y-1,z |
1_545 |
19 |
5 |
25433 |
206.8 |
0.2 |
0.593 |
4 |
2 |
0 |
0.000 |
12 |
15 |
|
A |
22 |
10 |
25433 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
21 |
6 |
25433 |
189.4 |
-0.8 |
0.391 |
1 |
0 |
0 |
0.001 |
13 |
16 |
|
C |
19 |
6 |
26935 |
x |
C |
-x-1/2,y-1/2,-z |
4_445 |
25 |
9 |
26935 |
184.6 |
-0.7 |
0.428 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
C |
18 |
6 |
26935 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
22 |
6 |
1906 |
172.2 |
-0.1 |
0.668 |
2 |
0 |
0 |
0.000 |
15 |
18 |
|
B |
11 |
5 |
25433 |
◊ |
A |
-x,y,-z+1 |
2_556 |
11 |
5 |
25433 |
95.0 |
0.6 |
0.713 |
2 |
1 |
0 |
0.000 |
16 |
19 |
|
C |
13 |
5 |
26935 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
25433 |
93.3 |
0.7 |
0.531 |
1 |
0 |
0 |
0.000 |
17 |
20 |
|
C |
9 |
5 |
26935 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
25433 |
76.5 |
1.9 |
0.840 |
1 |
1 |
0 |
0.000 |
18 |
21 |
|
[NA]C:2202 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
15 |
10 |
26935 |
69.3 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.299 |
22 |
|
[NA]A:2202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
25433 |
61.2 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.299 |
Average: |
65.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.299 |
19 |
23 |
|
[NA]C:2203 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
26935 |
61.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.214 |
20 |
24 |
|
[NH2]D:48 |
1 |
1 |
117 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
25433 |
45.1 |
0.4 |
0.725 |
0 |
0 |
0 |
0.000 |
25 |
|
[NH2]E:48 |
1 |
1 |
117 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
25433 |
45.0 |
0.5 |
0.735 |
0 |
0 |
0 |
0.000 |
26 |
|
[NH2]F:48 |
1 |
1 |
117 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
26935 |
44.5 |
0.4 |
0.748 |
0 |
0 |
0 |
0.000 |
Average: |
44.9 |
0.4 |
0.736 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[NH2]F:48 |
1 |
1 |
117 |
cf |
F |
x,y,z |
1_555 |
8 |
3 |
1510 |
44.8 |
0.4 |
0.814 |
0 |
0 |
0 |
0.000 |
28 |
|
[NH2]D:48 |
1 |
1 |
117 |
cf |
D |
x,y,z |
1_555 |
9 |
3 |
1528 |
44.1 |
0.4 |
0.828 |
0 |
0 |
0 |
0.000 |
29 |
|
[NH2]E:48 |
1 |
1 |
117 |
cf |
E |
x,y,z |
1_555 |
9 |
3 |
1906 |
44.0 |
0.4 |
0.751 |
0 |
0 |
0 |
0.000 |
Average: |
44.3 |
0.4 |
0.798 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
[NA]C:2204 |
1 |
1 |
125 |
f |
[NA]C:2203 |
x,y,z |
1_555 |
1 |
1 |
125 |
27.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.128 |
23 |
31 |
|
B |
7 |
2 |
25433 |
x |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
3 |
25433 |
26.2 |
0.8 |
0.704 |
0 |
0 |
0 |
0.000 |
24 |
32 |
|
[NA]C:2204 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
26935 |
23.2 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.052 |
25 |
33 |
|
A |
1 |
1 |
25433 |
◊ |
[NA]C:2202 |
-x-1/2,y-1/2,-z |
4_445 |
1 |
1 |
125 |
14.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.017 |
26 |
34 |
|
E |
2 |
1 |
1906 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
25433 |
9.1 |
0.3 |
0.739 |
0 |
0 |
0 |
0.000 |
27 |
35 |
|
[NA]C:2204 |
1 |
1 |
125 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
25433 |
9.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.010 |
28 |
36 |
|
A |
2 |
2 |
25433 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
25433 |
7.2 |
0.1 |
0.626 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
A |
1 |
1 |
25433 |
◊ |
[NA]C:2204 |
-x-1/2,y-1/2,-z |
4_445 |
1 |
1 |
125 |
1.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
|