| ## |
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 |
|
B |
296 |
71 |
16675 |
◊ |
A |
x,y,z |
1_555 |
305 |
75 |
16856 |
3025.0 |
-36.3 |
0.088 |
35 |
13 |
0 |
0.427 |
| 2 |
2 |
|
A |
41 |
15 |
16856 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
43 |
15 |
16675 |
435.8 |
-2.3 |
0.587 |
7 |
0 |
0 |
0.000 |
3 |
|
A |
38 |
13 |
16856 |
◊ |
B |
-y+2,x-y,z+1/3 |
2_755 |
33 |
12 |
16675 |
385.6 |
-1.4 |
0.614 |
6 |
0 |
0 |
0.000 |
| Average: |
410.7 |
-1.8 |
0.601 |
7 |
0 |
0 |
0.000 |
| 3 |
4 |
|
[GG3]B:8004 |
23 |
1 |
555 |
f |
B |
x,y,z |
1_555 |
60 |
26 |
16675 |
371.0 |
-0.9 |
0.711 |
6 |
0 |
0 |
0.057 |
5 |
|
[GG3]A:3001 |
22 |
1 |
556 |
f |
A |
x,y,z |
1_555 |
60 |
28 |
16856 |
364.5 |
-1.0 |
0.702 |
6 |
0 |
0 |
0.057 |
| Average: |
367.8 |
-0.9 |
0.707 |
6 |
0 |
0 |
0.057 |
| 4 |
6 |
|
B |
19 |
6 |
16675 |
◊ |
A |
x-y,-y+1,-z-1/3 |
5_564 |
18 |
6 |
16856 |
153.8 |
0.7 |
0.750 |
1 |
1 |
0 |
0.000 |
7 |
|
B |
15 |
6 |
16675 |
◊ |
A |
y,x-1,-z |
4_545 |
13 |
5 |
16856 |
131.6 |
0.6 |
0.766 |
1 |
2 |
0 |
0.000 |
| Average: |
142.7 |
0.6 |
0.758 |
1 |
2 |
0 |
0.000 |
| 5 |
8 |
|
[ACT]A:8003 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
16856 |
108.2 |
-0.1 |
0.683 |
2 |
0 |
0 |
0.008 |
| 6 |
9 |
|
[ACT]B:8002 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
10 |
16675 |
101.6 |
0.4 |
0.790 |
3 |
0 |
0 |
0.007 |
| 7 |
10 |
|
[ACT]A:8001 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
16856 |
101.5 |
0.5 |
0.789 |
2 |
0 |
0 |
0.003 |
| 8 |
11 |
|
[BME]B:9001 |
4 |
1 |
203 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
16675 |
99.8 |
-1.7 |
0.341 |
2 |
0 |
0 |
0.020 |
| 9 |
12 |
|
[MG]B:4002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
16675 |
47.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.083 |
13 |
|
[MG]A:3003 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
16856 |
45.5 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
46.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.083 |
| 10 |
14 |
|
[MG]B:4003 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
16675 |
42.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.096 |
15 |
|
[MG]A:3004 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
16856 |
42.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.096 |
| Average: |
42.4 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.096 |
| 11 |
16 |
|
[GG3]A:3001 |
3 |
1 |
556 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
16675 |
42.1 |
-0.8 |
0.450 |
0 |
0 |
0 |
0.012 |
17 |
|
[GG3]B:8004 |
4 |
1 |
555 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
16856 |
37.7 |
-0.7 |
0.497 |
0 |
0 |
0 |
0.012 |
| Average: |
39.9 |
-0.8 |
0.473 |
0 |
0 |
0 |
0.012 |
| 12 |
18 |
|
[MG]B:4001 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
16675 |
39.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.086 |
19 |
|
[MG]A:3002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
16856 |
36.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.086 |
| Average: |
38.4 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.086 |
| 13 |
20 |
|
A |
5 |
1 |
16856 |
◊ |
A |
y,x,-z |
4_555 |
5 |
1 |
16856 |
39.5 |
0.1 |
0.699 |
0 |
0 |
0 |
0.000 |
21 |
|
B |
3 |
1 |
16675 |
◊ |
B |
x-y+1,-y+2,-z-1/3 |
5_674 |
3 |
1 |
16675 |
20.6 |
0.5 |
0.817 |
0 |
0 |
0 |
0.000 |
| Average: |
30.0 |
0.3 |
0.758 |
0 |
0 |
0 |
0.000 |
| 14 |
22 |
|
[ACT]A:8003 |
4 |
1 |
183 |
f |
[ACT]A:8001 |
x,y,z |
1_555 |
4 |
1 |
184 |
38.9 |
0.1 |
0.743 |
0 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[GG3]B:8004 |
4 |
1 |
555 |
f |
[MG]B:4002 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.066 |
24 |
|
[GG3]A:3001 |
5 |
1 |
556 |
f |
[MG]A:3003 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.066 |
| Average: |
30.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.066 |
| 16 |
25 |
|
[GG3]A:3001 |
3 |
1 |
556 |
f |
[MG]A:3002 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.060 |
26 |
|
[GG3]B:8004 |
3 |
1 |
555 |
f |
[MG]B:4001 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.060 |
| Average: |
27.5 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.060 |
| 17 |
27 |
|
[GG3]B:8004 |
5 |
1 |
555 |
f |
[MG]B:4003 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.039 |
28 |
|
[GG3]A:3001 |
5 |
1 |
556 |
f |
[MG]A:3004 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.039 |
| Average: |
25.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.039 |
| 18 |
29 |
|
A |
6 |
4 |
16856 |
◊ |
B |
x-y,-y+1,-z-1/3 |
5_564 |
5 |
3 |
16675 |
17.0 |
0.2 |
0.631 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
2 |
2 |
16856 |
◊ |
B |
y,x-1,-z |
4_545 |
1 |
1 |
16675 |
3.8 |
-0.1 |
0.439 |
0 |
0 |
0 |
0.000 |
| Average: |
10.4 |
0.1 |
0.535 |
0 |
0 |
0 |
0.000 |
| 19 |
31 |
|
[MG]A:3004 |
1 |
1 |
98 |
f |
[MG]A:3002 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.015 |
| 20 |
32 |
|
[BME]B:9001 |
2 |
1 |
203 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
16856 |
8.4 |
-0.2 |
0.319 |
0 |
0 |
0 |
0.002 |
| 21 |
33 |
|
B |
1 |
1 |
16675 |
x |
B |
x-y,-y+1,-z-1/3 |
5_564 |
2 |
1 |
16675 |
7.7 |
0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
2 |
1 |
16856 |
x |
A |
y,x-1,-z |
4_545 |
1 |
1 |
16856 |
6.2 |
0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
| Average: |
7.0 |
0.0 |
0.603 |
0 |
0 |
0 |
0.000 |
| 22 |
35 |
|
[GG3]A:3001 |
1 |
1 |
556 |
f |
[ACT]A:8001 |
x,y,z |
1_555 |
1 |
1 |
184 |
5.4 |
-0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
| 23 |
36 |
|
[MG]B:4003 |
1 |
1 |
98 |
f |
[MG]B:4001 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.0 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.008 |
| 24 |
37 |
|
[MG]A:3003 |
1 |
1 |
98 |
f |
[MG]A:3002 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.006 |
| 25 |
38 |
|
[MG]B:4002 |
1 |
1 |
98 |
f |
[MG]B:4001 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.006 |
|