| ## |
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 |
92 |
25 |
12657 |
◊ |
B |
x,y,z |
1_555 |
96 |
25 |
13106 |
836.4 |
-17.4 |
0.010 |
4 |
0 |
0 |
0.549 |
2 |
|
C |
97 |
25 |
12993 |
◊ |
A |
-x+1,y,-z |
2_655 |
91 |
22 |
13195 |
819.7 |
-15.5 |
0.020 |
2 |
0 |
0 |
0.549 |
3 |
|
E |
100 |
25 |
12684 |
◊ |
E |
-x+2,y,-z+1 |
2_756 |
100 |
25 |
12684 |
809.6 |
-15.0 |
0.036 |
4 |
0 |
0 |
0.549 |
4 |
|
F |
85 |
23 |
12812 |
◊ |
F |
-x+2,y,-z+1 |
2_756 |
84 |
23 |
12812 |
764.6 |
-12.3 |
0.047 |
6 |
0 |
0 |
0.549 |
| Average: |
807.6 |
-15.1 |
0.028 |
4 |
0 |
0 |
0.549 |
| 2 |
5 |
|
D |
89 |
22 |
12657 |
◊ |
A |
-x+1,y,-z |
2_655 |
86 |
24 |
13195 |
788.7 |
-2.5 |
0.565 |
9 |
5 |
0 |
0.213 |
6 |
|
C |
82 |
22 |
12993 |
◊ |
B |
x,y,z |
1_555 |
84 |
21 |
13106 |
761.9 |
-4.6 |
0.400 |
10 |
2 |
0 |
0.213 |
7 |
|
F |
85 |
21 |
12812 |
◊ |
E |
-x+2,y,-z+1 |
2_756 |
79 |
21 |
12684 |
722.1 |
-8.0 |
0.195 |
3 |
0 |
0 |
0.213 |
| Average: |
757.6 |
-5.0 |
0.387 |
7 |
2 |
0 |
0.213 |
| 3 |
8 |
|
B |
55 |
12 |
13106 |
◊ |
F |
x-1/2,y+1/2,z |
3_455 |
56 |
15 |
12812 |
528.7 |
-1.4 |
0.581 |
1 |
1 |
0 |
0.000 |
| 4 |
9 |
|
A |
53 |
17 |
13195 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
54 |
14 |
12657 |
467.6 |
-0.3 |
0.651 |
3 |
2 |
0 |
0.000 |
10 |
|
C |
50 |
16 |
12993 |
◊ |
E |
-x+3/2,y-1/2,-z+1 |
4_646 |
51 |
15 |
12684 |
463.3 |
2.1 |
0.804 |
4 |
4 |
0 |
0.000 |
| Average: |
465.5 |
0.9 |
0.728 |
4 |
3 |
0 |
0.000 |
| 5 |
11 |
|
F |
38 |
8 |
12812 |
◊ |
D |
-x+3/2,y-1/2,-z |
4_645 |
30 |
9 |
12657 |
296.8 |
-2.2 |
0.344 |
1 |
3 |
0 |
0.000 |
12 |
|
A |
33 |
8 |
13195 |
◊ |
E |
-x+3/2,y-1/2,-z+1 |
4_646 |
27 |
9 |
12684 |
240.9 |
-4.0 |
0.161 |
0 |
0 |
0 |
0.000 |
| Average: |
268.9 |
-3.1 |
0.252 |
1 |
2 |
0 |
0.000 |
| 6 |
13 |
|
F |
33 |
9 |
12812 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
29 |
9 |
12993 |
265.1 |
-1.9 |
0.410 |
2 |
0 |
0 |
0.000 |
| 7 |
14 |
|
C |
23 |
8 |
12993 |
◊ |
B |
-x+3/2,y-1/2,-z+1 |
4_646 |
29 |
8 |
13106 |
259.1 |
-2.2 |
0.345 |
1 |
2 |
0 |
0.000 |
| 8 |
15 |
|
C |
31 |
10 |
12993 |
◊ |
A |
x,y,z |
1_555 |
31 |
7 |
13195 |
257.4 |
-1.8 |
0.420 |
1 |
0 |
0 |
0.000 |
16 |
|
F |
28 |
8 |
12812 |
◊ |
A |
-x+1,y,-z |
2_655 |
23 |
7 |
13195 |
231.2 |
-2.2 |
0.309 |
0 |
0 |
0 |
0.000 |
| Average: |
244.3 |
-2.0 |
0.364 |
1 |
0 |
0 |
0.000 |
| 9 |
17 |
|
D |
23 |
7 |
12657 |
◊ |
B |
-x+1,y,-z |
2_655 |
21 |
6 |
13106 |
180.9 |
-0.1 |
0.599 |
1 |
1 |
0 |
0.000 |
| 10 |
18 |
|
[ESA]A:500 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
27 |
14 |
13195 |
141.8 |
2.9 |
0.476 |
5 |
0 |
0 |
0.000 |
| 11 |
19 |
|
[ESA]F:500 |
6 |
1 |
223 |
f |
F |
x,y,z |
1_555 |
25 |
12 |
12812 |
136.7 |
2.8 |
0.441 |
5 |
0 |
0 |
0.000 |
| 12 |
20 |
|
[ESA]C:500 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
22 |
13 |
12993 |
134.4 |
3.2 |
0.471 |
5 |
0 |
0 |
0.000 |
| 13 |
21 |
|
[ESA]E:500 |
6 |
1 |
221 |
f |
E |
x,y,z |
1_555 |
27 |
13 |
12684 |
130.3 |
3.1 |
0.529 |
3 |
0 |
0 |
0.000 |
| 14 |
22 |
|
[ESA]B:500 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
26 |
13 |
13106 |
130.2 |
3.0 |
0.508 |
2 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[ESA]D:500 |
6 |
1 |
221 |
f |
D |
x,y,z |
1_555 |
26 |
14 |
12657 |
129.1 |
3.2 |
0.502 |
4 |
0 |
0 |
0.000 |
| 16 |
24 |
|
E |
16 |
5 |
12684 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
13106 |
117.7 |
-0.9 |
0.484 |
0 |
0 |
0 |
0.000 |
25 |
|
E |
16 |
5 |
12684 |
◊ |
D |
-x+2,y,-z+1 |
2_756 |
12 |
5 |
12657 |
97.2 |
-1.8 |
0.281 |
1 |
0 |
0 |
0.000 |
| Average: |
107.4 |
-1.4 |
0.383 |
1 |
0 |
0 |
0.000 |
| 17 |
26 |
|
B |
4 |
1 |
13106 |
◊ |
A |
-x+1,y,-z |
2_655 |
4 |
1 |
13195 |
46.0 |
-1.5 |
0.101 |
0 |
0 |
0 |
0.032 |
27 |
|
F |
4 |
1 |
12812 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
12684 |
43.5 |
-1.4 |
0.103 |
0 |
0 |
0 |
0.032 |
28 |
|
D |
4 |
1 |
12657 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
12993 |
37.4 |
-1.2 |
0.148 |
0 |
0 |
0 |
0.032 |
| Average: |
42.3 |
-1.4 |
0.117 |
0 |
0 |
0 |
0.032 |
| 18 |
29 |
|
[MG]D:501 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
9 |
12657 |
44.9 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.449 |
30 |
|
[MG]E:501 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
13 |
8 |
12684 |
44.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.449 |
31 |
|
[MG]F:501 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
12 |
8 |
12812 |
44.0 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.449 |
32 |
|
[MG]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
13106 |
43.3 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.449 |
33 |
|
[MG]C:501 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
7 |
12993 |
41.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.449 |
34 |
|
[MG]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
13195 |
40.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.449 |
| Average: |
43.1 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.449 |
| 19 |
35 |
|
[ESA]F:500 |
3 |
1 |
223 |
f |
[MG]F:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.155 |
| 20 |
36 |
|
[ESA]C:500 |
4 |
1 |
221 |
f |
[MG]C:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.166 |
37 |
|
[ESA]A:500 |
4 |
1 |
222 |
f |
[MG]A:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.166 |
38 |
|
[ESA]D:500 |
3 |
1 |
221 |
f |
[MG]D:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.9 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.166 |
| Average: |
27.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.166 |
| 21 |
39 |
|
[ESA]B:500 |
3 |
1 |
222 |
f |
[MG]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.072 |
| 22 |
40 |
|
[ESA]E:500 |
3 |
1 |
221 |
f |
[MG]E:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.153 |
|