## |
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 |
|
E |
141 |
35 |
12337 |
◊ |
A |
x,y,z |
1_555 |
175 |
46 |
18360 |
1523.5 |
-17.3 |
0.170 |
14 |
5 |
0 |
0.340 |
2 |
2 |
|
B |
143 |
37 |
17072 |
◊ |
A |
x,y,z |
1_555 |
145 |
35 |
18360 |
1345.3 |
-13.3 |
0.117 |
9 |
9 |
0 |
0.253 |
3 |
|
D |
137 |
37 |
16678 |
◊ |
C |
x,y,z |
1_555 |
143 |
36 |
17625 |
1328.9 |
-12.5 |
0.156 |
10 |
8 |
0 |
0.253 |
Average: |
1337.1 |
-12.9 |
0.137 |
10 |
9 |
0 |
0.253 |
3 |
4 |
|
D |
130 |
36 |
16678 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
117 |
27 |
17731 |
1137.2 |
-0.1 |
0.604 |
4 |
2 |
0 |
0.000 |
4 |
5 |
|
F |
125 |
39 |
17731 |
◊ |
A |
x,y,z |
1_555 |
107 |
26 |
18360 |
1035.7 |
1.1 |
0.767 |
8 |
8 |
0 |
0.000 |
5 |
6 |
|
B |
90 |
25 |
17072 |
◊ |
C |
x,y,z |
1_555 |
109 |
30 |
17625 |
847.5 |
-7.8 |
0.252 |
6 |
1 |
0 |
0.052 |
6 |
7 |
|
E |
79 |
17 |
12337 |
◊ |
C |
x,y,z |
1_555 |
82 |
24 |
17625 |
766.5 |
-8.9 |
0.231 |
4 |
3 |
0 |
0.123 |
7 |
8 |
|
E |
58 |
17 |
12337 |
◊ |
D |
x,y,z |
1_555 |
80 |
22 |
16678 |
681.2 |
-5.5 |
0.410 |
4 |
3 |
0 |
0.085 |
8 |
9 |
|
E |
59 |
16 |
12337 |
◊ |
B |
x,y,z |
1_555 |
79 |
21 |
17072 |
632.8 |
-3.5 |
0.537 |
0 |
4 |
0 |
0.020 |
9 |
10 |
|
C |
62 |
18 |
17625 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
38 |
11 |
12337 |
506.6 |
-3.1 |
0.495 |
1 |
3 |
0 |
0.000 |
10 |
11 |
|
F |
48 |
13 |
17731 |
◊ |
B |
x,y,z |
1_555 |
48 |
11 |
17072 |
442.0 |
1.4 |
0.756 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[GTP]C:501 |
31 |
1 |
631 |
f |
C |
x,y,z |
1_555 |
69 |
30 |
17625 |
414.4 |
-2.8 |
0.593 |
10 |
0 |
0 |
0.105 |
13 |
|
[GTP]A:501 |
31 |
1 |
629 |
f |
A |
x,y,z |
1_555 |
70 |
30 |
18360 |
405.8 |
-3.0 |
0.541 |
10 |
0 |
0 |
0.105 |
Average: |
410.1 |
-2.9 |
0.567 |
10 |
0 |
0 |
0.105 |
12 |
14 |
|
[ACP]F:703 |
31 |
1 |
639 |
f |
F |
x,y,z |
1_555 |
51 |
22 |
17731 |
408.0 |
-0.4 |
0.673 |
4 |
0 |
0 |
0.011 |
13 |
15 |
|
[GDP]B:501 |
27 |
1 |
559 |
f |
B |
x,y,z |
1_555 |
65 |
28 |
17072 |
401.2 |
-6.4 |
0.579 |
7 |
0 |
0 |
0.143 |
16 |
|
[GDP]D:600 |
27 |
1 |
559 |
f |
D |
x,y,z |
1_555 |
67 |
30 |
16678 |
400.3 |
-6.6 |
0.561 |
8 |
0 |
0 |
0.143 |
Average: |
400.7 |
-6.5 |
0.570 |
8 |
0 |
0 |
0.143 |
14 |
17 |
|
C |
55 |
12 |
17625 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
44 |
11 |
18360 |
384.1 |
-0.8 |
0.600 |
0 |
3 |
0 |
0.000 |
15 |
18 |
|
C |
35 |
12 |
17625 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
35 |
12 |
18360 |
306.8 |
-1.2 |
0.458 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
C |
27 |
10 |
17625 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
5 |
12337 |
236.4 |
-0.7 |
0.541 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[MES]B:505 |
12 |
1 |
338 |
f |
B |
x,y,z |
1_555 |
40 |
12 |
17072 |
236.3 |
7.2 |
0.494 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[MES]B:504 |
12 |
1 |
333 |
◊ |
B |
x,y,z |
1_555 |
29 |
12 |
17072 |
200.7 |
7.8 |
0.470 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
C |
25 |
6 |
17625 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
30 |
10 |
17072 |
194.3 |
-1.4 |
0.406 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
B |
18 |
6 |
17072 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
23 |
7 |
16678 |
177.5 |
-1.1 |
0.421 |
1 |
1 |
0 |
0.000 |
21 |
24 |
|
B |
17 |
6 |
17072 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
20 |
9 |
12337 |
174.3 |
0.6 |
0.738 |
1 |
2 |
0 |
0.000 |
22 |
25 |
|
D |
12 |
5 |
16678 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
11 |
6 |
12337 |
114.4 |
2.1 |
0.882 |
2 |
3 |
0 |
0.000 |
23 |
26 |
|
C |
8 |
4 |
17625 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
10 |
3 |
17731 |
96.2 |
-0.8 |
0.362 |
0 |
0 |
0 |
0.000 |
24 |
27 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
18360 |
62.0 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.132 |
25 |
28 |
|
[GTP]A:501 |
9 |
1 |
629 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
17072 |
56.0 |
1.1 |
0.805 |
1 |
0 |
0 |
0.000 |
29 |
|
[GTP]C:501 |
7 |
1 |
631 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
16678 |
40.0 |
0.9 |
0.788 |
1 |
0 |
0 |
0.000 |
Average: |
48.0 |
1.0 |
0.796 |
1 |
0 |
0 |
0.000 |
26 |
30 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
16678 |
51.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.079 |
31 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
17072 |
50.6 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.079 |
Average: |
50.8 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.079 |
27 |
32 |
|
[ACP]F:703 |
4 |
1 |
639 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
18360 |
49.0 |
0.6 |
0.647 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[MG]F:701 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
10 |
6 |
17731 |
46.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.027 |
29 |
34 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
17625 |
43.6 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.070 |
35 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
18360 |
41.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.070 |
Average: |
42.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.070 |
30 |
36 |
|
[CA]A:503 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
18360 |
43.5 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.179 |
37 |
|
[CA]C:503 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
3 |
17625 |
42.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.179 |
Average: |
43.1 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.179 |
31 |
38 |
|
[CA]A:505 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
18360 |
41.2 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.088 |
32 |
39 |
|
C |
7 |
4 |
17625 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
12 |
6 |
17625 |
38.9 |
-0.7 |
0.433 |
0 |
0 |
0 |
0.000 |
33 |
40 |
|
[ACP]F:703 |
8 |
1 |
639 |
f |
[MG]F:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
37.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.021 |
34 |
41 |
|
[MG]F:702 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
6 |
4 |
17731 |
36.6 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.022 |
35 |
42 |
|
C |
6 |
2 |
17625 |
f |
[MG]B:506 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
98 |
36.0 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.050 |
36 |
43 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
4 |
1 |
631 |
32.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.062 |
44 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
4 |
1 |
629 |
32.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
32.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.062 |
37 |
45 |
|
[ACP]F:703 |
3 |
1 |
639 |
f |
[MG]F:702 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.020 |
38 |
46 |
|
[GDP]D:600 |
7 |
1 |
559 |
f |
[MG]D:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.062 |
47 |
|
[GDP]B:501 |
7 |
1 |
559 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
30.9 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.062 |
39 |
48 |
|
[MES]B:504 |
4 |
1 |
333 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
18360 |
30.8 |
0.4 |
0.091 |
0 |
0 |
0 |
0.000 |
40 |
49 |
|
B |
4 |
2 |
17072 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
2 |
12337 |
30.1 |
-0.4 |
0.387 |
0 |
0 |
0 |
0.000 |
41 |
50 |
|
B |
5 |
3 |
17072 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
17731 |
29.0 |
0.1 |
0.615 |
0 |
0 |
0 |
0.000 |
42 |
51 |
|
[MG]B:506 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
17072 |
28.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.002 |
43 |
52 |
|
[CA]B:503 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
17072 |
28.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.028 |
44 |
53 |
|
C |
5 |
4 |
17625 |
◊ |
[CA]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
28.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.003 |
45 |
54 |
|
A |
4 |
2 |
18360 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
2 |
1 |
17731 |
19.9 |
0.2 |
0.600 |
0 |
0 |
0 |
0.000 |
46 |
55 |
|
[MG]F:702 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
18360 |
18.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
56 |
|
[CA]A:505 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12337 |
15.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.030 |
48 |
57 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
16678 |
12.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.008 |
58 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17072 |
12.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
Average: |
12.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
49 |
59 |
|
D |
1 |
1 |
16678 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
18360 |
9.4 |
0.2 |
0.428 |
0 |
0 |
0 |
0.000 |
50 |
60 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
17625 |
8.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.003 |
|