## |
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 |
170 |
48 |
7106 |
◊ |
B |
x,y,z |
1_555 |
169 |
49 |
7114 |
1564.6 |
-17.7 |
0.327 |
25 |
2 |
0 |
0.896 |
2 |
|
C |
172 |
48 |
7043 |
◊ |
A |
x,y,z |
1_555 |
172 |
48 |
7111 |
1555.2 |
-17.4 |
0.342 |
25 |
2 |
0 |
0.896 |
Average: |
1559.9 |
-17.6 |
0.334 |
25 |
2 |
0 |
0.896 |
2 |
3 |
|
D |
50 |
14 |
7106 |
◊ |
A |
x,y,z |
1_555 |
52 |
14 |
7111 |
490.9 |
-10.5 |
0.037 |
2 |
0 |
0 |
0.496 |
4 |
|
C |
53 |
15 |
7043 |
◊ |
B |
x,y,z |
1_555 |
50 |
13 |
7114 |
487.7 |
-10.4 |
0.043 |
2 |
0 |
0 |
0.496 |
Average: |
489.3 |
-10.4 |
0.040 |
2 |
0 |
0 |
0.496 |
3 |
5 |
|
C |
49 |
15 |
7043 |
◊ |
B |
x,y,z-1 |
1_554 |
50 |
16 |
7114 |
470.2 |
-6.0 |
0.338 |
2 |
0 |
0 |
0.000 |
6 |
|
A |
50 |
15 |
7111 |
◊ |
D |
x,y-1,z |
1_545 |
49 |
16 |
7106 |
468.8 |
-5.7 |
0.362 |
2 |
0 |
0 |
0.000 |
Average: |
469.5 |
-5.9 |
0.350 |
2 |
0 |
0 |
0.000 |
4 |
7 |
|
[KM3]D:201 |
26 |
1 |
791 |
cf |
D |
x,y,z |
1_555 |
57 |
23 |
7106 |
392.7 |
1.8 |
0.612 |
8 |
0 |
0 |
0.145 |
8 |
|
[KM3]B:201 |
26 |
1 |
792 |
cf |
B |
x,y,z |
1_555 |
56 |
24 |
7114 |
392.0 |
1.9 |
0.608 |
8 |
0 |
0 |
0.145 |
9 |
|
[KM3]A:201 |
26 |
1 |
790 |
cf |
A |
x,y,z |
1_555 |
54 |
23 |
7111 |
391.5 |
1.9 |
0.610 |
8 |
0 |
0 |
0.145 |
10 |
|
[KM3]C:201 |
26 |
1 |
788 |
cf |
C |
x,y,z |
1_555 |
56 |
23 |
7043 |
391.0 |
2.1 |
0.633 |
8 |
0 |
0 |
0.145 |
Average: |
391.8 |
1.9 |
0.616 |
8 |
0 |
0 |
0.145 |
5 |
11 |
|
B |
19 |
6 |
7114 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
7111 |
196.9 |
0.1 |
0.738 |
2 |
0 |
0 |
0.014 |
12 |
|
D |
19 |
6 |
7106 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
7043 |
194.6 |
0.1 |
0.745 |
2 |
0 |
0 |
0.014 |
Average: |
195.8 |
0.1 |
0.741 |
2 |
0 |
0 |
0.014 |
6 |
13 |
|
[KM3]C:201 |
18 |
1 |
788 |
◊ |
B |
x,y,z |
1_555 |
17 |
4 |
7114 |
141.5 |
-1.2 |
0.282 |
0 |
0 |
0 |
0.095 |
14 |
|
[KM3]D:201 |
17 |
1 |
791 |
◊ |
A |
x,y,z |
1_555 |
18 |
4 |
7111 |
140.5 |
-1.0 |
0.296 |
0 |
0 |
0 |
0.095 |
15 |
|
[KM3]A:201 |
17 |
1 |
790 |
◊ |
D |
x,y,z |
1_555 |
17 |
4 |
7106 |
139.1 |
-1.0 |
0.284 |
0 |
0 |
0 |
0.095 |
16 |
|
[KM3]B:201 |
16 |
1 |
792 |
◊ |
C |
x,y,z |
1_555 |
18 |
4 |
7043 |
137.2 |
-0.9 |
0.298 |
0 |
0 |
0 |
0.095 |
Average: |
139.6 |
-1.1 |
0.290 |
0 |
0 |
0 |
0.095 |
7 |
17 |
|
A |
18 |
5 |
7111 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
17 |
5 |
7106 |
122.2 |
2.5 |
0.928 |
0 |
0 |
0 |
0.000 |
18 |
|
B |
18 |
5 |
7114 |
◊ |
B |
-x,y,-z+1 |
2_556 |
18 |
5 |
7114 |
120.1 |
2.6 |
0.928 |
0 |
0 |
0 |
0.000 |
19 |
|
C |
17 |
5 |
7043 |
◊ |
C |
-x,y,-z |
2_555 |
17 |
5 |
7043 |
117.8 |
2.0 |
0.914 |
0 |
0 |
0 |
0.000 |
Average: |
120.0 |
2.4 |
0.923 |
0 |
0 |
0 |
0.000 |
8 |
20 |
|
[KM3]C:201 |
10 |
1 |
788 |
◊ |
[KM3]B:201 |
x,y,z |
1_555 |
10 |
1 |
792 |
73.0 |
-4.0 |
0.135 |
0 |
0 |
0 |
0.177 |
21 |
|
[KM3]D:201 |
10 |
1 |
791 |
◊ |
[KM3]A:201 |
x,y,z |
1_555 |
10 |
1 |
790 |
72.9 |
-4.1 |
0.138 |
0 |
0 |
0 |
0.177 |
Average: |
73.0 |
-4.0 |
0.136 |
0 |
0 |
0 |
0.177 |
9 |
22 |
|
[ACT]A:202 |
4 |
1 |
183 |
◊ |
[KM3]D:201 |
x,y,z |
1_555 |
12 |
1 |
791 |
59.9 |
-1.3 |
0.386 |
0 |
0 |
0 |
0.057 |
10 |
23 |
|
[ACT]B:202 |
4 |
1 |
182 |
f |
[KM3]C:201 |
x,y,z |
1_555 |
11 |
1 |
788 |
58.6 |
-1.5 |
0.378 |
0 |
0 |
0 |
0.065 |
11 |
24 |
|
[ACT]B:202 |
4 |
1 |
182 |
◊ |
[KM3]B:201 |
x,y,z |
1_555 |
11 |
1 |
792 |
56.0 |
-1.3 |
0.372 |
0 |
0 |
0 |
0.056 |
12 |
25 |
|
[ACT]A:202 |
4 |
1 |
183 |
f |
[KM3]A:201 |
x,y,z |
1_555 |
10 |
1 |
790 |
54.6 |
-1.5 |
0.363 |
0 |
0 |
0 |
0.064 |
13 |
26 |
|
[ACT]B:202 |
3 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7114 |
13.8 |
0.3 |
0.781 |
0 |
0 |
0 |
0.000 |
14 |
27 |
|
[ACT]A:202 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
7111 |
13.5 |
0.3 |
0.880 |
0 |
0 |
0 |
0.000 |
15 |
28 |
|
[ACT]B:202 |
3 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
7043 |
13.4 |
0.3 |
0.781 |
0 |
0 |
0 |
0.000 |
16 |
29 |
|
[ACT]A:202 |
3 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
7106 |
12.9 |
0.2 |
0.777 |
0 |
0 |
0 |
0.000 |
|