## |
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 |
|
A |
98 |
33 |
17045 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
106 |
37 |
17055 |
872.3 |
-1.8 |
0.568 |
0 |
0 |
0 |
0.000 |
2 |
2 |
|
F |
106 |
12 |
3007 |
◊ |
B |
x,y,z |
1_555 |
109 |
34 |
17055 |
811.4 |
-16.9 |
0.160 |
8 |
0 |
0 |
1.000 |
3 |
|
D |
102 |
12 |
2936 |
◊ |
A |
x,y,z |
1_555 |
106 |
33 |
17045 |
791.2 |
-16.5 |
0.160 |
7 |
0 |
0 |
1.000 |
Average: |
801.3 |
-16.7 |
0.160 |
8 |
0 |
0 |
1.000 |
3 |
4 |
|
B |
84 |
26 |
17055 |
◊ |
A |
x,y,z |
1_555 |
81 |
24 |
17045 |
715.6 |
-1.3 |
0.575 |
3 |
4 |
0 |
0.000 |
4 |
5 |
|
D |
68 |
12 |
2936 |
◊ |
C |
x,y,z |
1_555 |
64 |
10 |
2566 |
546.1 |
-4.1 |
0.737 |
15 |
0 |
0 |
0.499 |
6 |
|
F |
63 |
12 |
3007 |
◊ |
E |
x,y,z |
1_555 |
62 |
10 |
2564 |
520.6 |
-5.0 |
0.709 |
15 |
0 |
0 |
0.499 |
Average: |
533.3 |
-4.5 |
0.723 |
15 |
0 |
0 |
0.499 |
5 |
7 |
|
E |
50 |
7 |
2564 |
◊ |
B |
x,y,z |
1_555 |
60 |
25 |
17055 |
489.2 |
-7.1 |
0.549 |
8 |
0 |
0 |
0.544 |
8 |
|
C |
47 |
7 |
2566 |
◊ |
A |
x,y,z |
1_555 |
60 |
27 |
17045 |
474.6 |
-6.3 |
0.505 |
7 |
0 |
0 |
0.544 |
Average: |
481.9 |
-6.7 |
0.527 |
8 |
0 |
0 |
0.544 |
6 |
9 |
|
A |
45 |
14 |
17045 |
◊ |
B |
x-y,x,z+7/6 |
6_556 |
51 |
21 |
17055 |
406.4 |
5.0 |
0.911 |
1 |
3 |
0 |
0.000 |
7 |
10 |
|
B |
28 |
6 |
17055 |
◊ |
A |
-x+1,-y+1,z-1/2 |
4_664 |
19 |
3 |
17045 |
181.8 |
0.7 |
0.669 |
0 |
3 |
0 |
0.000 |
8 |
11 |
|
[NRI]E:7 |
11 |
1 |
323 |
◊ |
B |
x,y,z |
1_555 |
19 |
11 |
17055 |
144.8 |
-2.2 |
0.571 |
2 |
0 |
0 |
0.182 |
12 |
|
[NRI]C:7 |
11 |
1 |
321 |
◊ |
A |
x,y,z |
1_555 |
20 |
11 |
17045 |
144.2 |
-2.3 |
0.547 |
2 |
0 |
0 |
0.182 |
Average: |
144.5 |
-2.2 |
0.559 |
2 |
0 |
0 |
0.182 |
9 |
13 |
|
[MES]A:402 |
9 |
1 |
332 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
17045 |
139.0 |
4.6 |
0.113 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
C |
14 |
3 |
2566 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
22 |
8 |
17055 |
136.4 |
-3.9 |
0.361 |
0 |
0 |
0 |
0.176 |
15 |
|
A |
23 |
8 |
17045 |
◊ |
E |
x-y,x,z+1/6 |
6_555 |
14 |
3 |
2564 |
135.7 |
-4.0 |
0.360 |
2 |
0 |
0 |
0.176 |
Average: |
136.0 |
-4.0 |
0.361 |
1 |
0 |
0 |
0.176 |
11 |
16 |
|
[NRI]C:7 |
9 |
1 |
321 |
cf |
C |
x,y,z |
1_555 |
17 |
2 |
2566 |
130.1 |
1.4 |
0.772 |
0 |
0 |
0 |
0.000 |
17 |
|
[NRI]E:7 |
9 |
1 |
323 |
cf |
E |
x,y,z |
1_555 |
17 |
2 |
2564 |
129.2 |
1.3 |
0.778 |
0 |
0 |
0 |
0.000 |
Average: |
129.6 |
1.3 |
0.775 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[MES]B:401 |
11 |
1 |
338 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
17055 |
124.6 |
3.8 |
0.039 |
0 |
0 |
0 |
0.000 |
13 |
19 |
|
D |
17 |
2 |
2936 |
◊ |
F |
x-y,x,z+1/6 |
6_555 |
16 |
2 |
3007 |
117.8 |
4.1 |
0.840 |
1 |
0 |
0 |
0.000 |
14 |
20 |
|
A |
12 |
6 |
17045 |
f |
[MES]B:402 |
x-y,x,z+7/6 |
6_556 |
7 |
1 |
338 |
104.9 |
2.0 |
0.110 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[MES]B:402 |
6 |
1 |
338 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
17055 |
101.8 |
3.4 |
0.481 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[GOL]A:401 |
6 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
17045 |
92.9 |
0.3 |
0.619 |
0 |
0 |
0 |
0.005 |
23 |
|
[GOL]F:101 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
17055 |
90.8 |
0.3 |
0.627 |
1 |
0 |
0 |
0.005 |
Average: |
91.9 |
0.3 |
0.623 |
1 |
0 |
0 |
0.005 |
17 |
24 |
|
B |
11 |
5 |
17055 |
x |
B |
-x+1,-y+1,z-1/2 |
4_664 |
7 |
4 |
17055 |
87.1 |
0.6 |
0.652 |
0 |
4 |
0 |
0.000 |
18 |
25 |
|
C |
10 |
1 |
2566 |
◊ |
E |
x-y,x,z+1/6 |
6_555 |
10 |
1 |
2564 |
83.6 |
-1.2 |
0.590 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
C |
10 |
1 |
2566 |
◊ |
F |
x-y,x,z+1/6 |
6_555 |
12 |
3 |
3007 |
78.7 |
1.7 |
0.754 |
0 |
0 |
0 |
0.000 |
27 |
|
D |
11 |
2 |
2936 |
◊ |
E |
x-y,x,z+1/6 |
6_555 |
10 |
1 |
2564 |
72.0 |
2.1 |
0.790 |
0 |
0 |
0 |
0.000 |
Average: |
75.3 |
1.9 |
0.772 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[GOL]F:101 |
6 |
1 |
219 |
◊ |
F |
x,y,z |
1_555 |
12 |
3 |
3007 |
77.5 |
1.3 |
0.661 |
1 |
0 |
0 |
0.000 |
29 |
|
[GOL]A:401 |
6 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
12 |
3 |
2936 |
76.4 |
1.5 |
0.685 |
1 |
0 |
0 |
0.000 |
Average: |
76.9 |
1.4 |
0.673 |
1 |
0 |
0 |
0.000 |
21 |
30 |
|
[NA]C:101 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
2566 |
54.4 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.435 |
31 |
|
[NA]E:101 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
8 |
3 |
2564 |
53.8 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.435 |
Average: |
54.1 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.435 |
22 |
32 |
|
[NA]C:101 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
2936 |
44.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.255 |
33 |
|
[NA]E:101 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
3007 |
43.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.255 |
Average: |
43.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.255 |
23 |
34 |
|
B |
3 |
2 |
17055 |
f |
[MES]A:402 |
-x+1,-y+1,z-1/2 |
4_664 |
3 |
1 |
332 |
37.3 |
0.5 |
0.141 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
[GOL]F:101 |
3 |
1 |
219 |
f |
E |
x,y,z |
1_555 |
7 |
2 |
2564 |
29.1 |
-1.0 |
0.484 |
0 |
0 |
0 |
0.052 |
36 |
|
[GOL]A:401 |
3 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
2566 |
28.1 |
-0.9 |
0.484 |
0 |
0 |
0 |
0.052 |
Average: |
28.6 |
-0.9 |
0.484 |
0 |
0 |
0 |
0.052 |
25 |
37 |
|
[MES]A:402 |
2 |
1 |
332 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17055 |
22.1 |
0.9 |
0.393 |
0 |
0 |
0 |
0.000 |
26 |
38 |
|
[MES]B:401 |
1 |
1 |
338 |
◊ |
[MES]A:402 |
x,y,z |
1_555 |
3 |
1 |
332 |
12.4 |
0.6 |
0.064 |
0 |
0 |
0 |
0.000 |
27 |
39 |
|
[MES]B:401 |
1 |
1 |
338 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
17045 |
8.4 |
0.3 |
0.424 |
0 |
0 |
0 |
0.000 |
28 |
40 |
|
[NRI]E:7 |
3 |
1 |
323 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
3007 |
7.4 |
0.2 |
0.516 |
0 |
0 |
0 |
0.000 |
41 |
|
[NRI]C:7 |
2 |
1 |
321 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
2936 |
4.7 |
0.1 |
0.509 |
0 |
0 |
0 |
0.000 |
Average: |
6.1 |
0.2 |
0.513 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
A |
1 |
1 |
17045 |
◊ |
F |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
3007 |
6.4 |
-0.1 |
0.359 |
0 |
0 |
0 |
0.000 |
43 |
|
D |
2 |
1 |
2936 |
◊ |
B |
x-y,x,z+1/6 |
6_555 |
2 |
1 |
17055 |
5.9 |
-0.1 |
0.421 |
0 |
0 |
0 |
0.000 |
Average: |
6.1 |
-0.1 |
0.390 |
0 |
0 |
0 |
0.000 |
30 |
44 |
|
[MES]B:401 |
1 |
1 |
338 |
f |
A |
-y+1,x-y+1,z-2/3 |
2_664 |
1 |
1 |
17045 |
3.2 |
-0.0 |
0.245 |
0 |
0 |
0 |
0.001 |
31 |
45 |
|
A |
1 |
1 |
17045 |
x |
A |
-y+1,x-y+1,z-2/3 |
2_664 |
1 |
1 |
17045 |
1.4 |
0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
32 |
46 |
|
A |
1 |
1 |
17045 |
◊ |
[NA]E:101 |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
125 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
|