| ## |
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 |
|
F |
190 |
48 |
13750 |
◊ |
F |
-x,-y,z |
2_555 |
190 |
48 |
13750 |
1853.0 |
-5.0 |
0.762 |
34 |
20 |
0 |
0.448 |
2 |
|
E |
193 |
48 |
13780 |
◊ |
E |
-x,-y,z |
2_555 |
193 |
48 |
13780 |
1851.3 |
-2.4 |
0.836 |
36 |
16 |
0 |
0.448 |
3 |
|
B |
182 |
49 |
13775 |
◊ |
A |
x,y,z |
1_555 |
181 |
44 |
13749 |
1747.8 |
-4.2 |
0.729 |
32 |
16 |
0 |
0.448 |
4 |
|
D |
171 |
39 |
13526 |
◊ |
C |
x,y,z |
1_555 |
169 |
45 |
13208 |
1641.0 |
-5.2 |
0.816 |
34 |
15 |
0 |
0.448 |
| Average: |
1773.2 |
-4.2 |
0.786 |
34 |
17 |
0 |
0.448 |
| 2 |
5 |
|
F |
140 |
35 |
13750 |
◊ |
E |
x,y,z |
1_555 |
144 |
39 |
13780 |
1463.3 |
-18.2 |
0.077 |
14 |
5 |
0 |
0.535 |
6 |
|
C |
136 |
38 |
13208 |
◊ |
A |
x,y,z |
1_555 |
134 |
33 |
13749 |
1344.0 |
-20.9 |
0.030 |
7 |
1 |
0 |
0.535 |
7 |
|
D |
132 |
35 |
13526 |
◊ |
B |
x,y,z |
1_555 |
129 |
34 |
13775 |
1254.2 |
-23.0 |
0.020 |
6 |
1 |
0 |
0.535 |
| Average: |
1353.8 |
-20.7 |
0.042 |
9 |
2 |
0 |
0.535 |
| 3 |
8 |
|
B |
58 |
20 |
13775 |
◊ |
F |
x-1/2,-y+1/2,-z-1 |
4_454 |
59 |
14 |
13750 |
600.0 |
-3.0 |
0.533 |
9 |
5 |
0 |
0.000 |
| 4 |
9 |
|
B |
55 |
15 |
13775 |
◊ |
A |
x-1/2,-y+1/2,-z-1 |
4_454 |
55 |
16 |
13749 |
524.8 |
0.0 |
0.744 |
4 |
7 |
0 |
0.000 |
| 5 |
10 |
|
[TRH]E:500 |
33 |
1 |
677 |
f |
E |
x,y,z |
1_555 |
66 |
31 |
13780 |
457.2 |
-2.2 |
0.679 |
12 |
0 |
0 |
0.315 |
11 |
|
[TRH]B:500 |
32 |
1 |
680 |
f |
B |
x,y,z |
1_555 |
67 |
31 |
13775 |
457.0 |
-2.5 |
0.657 |
13 |
0 |
0 |
0.315 |
12 |
|
[TRH]F:500 |
31 |
1 |
684 |
f |
F |
x,y,z |
1_555 |
64 |
30 |
13750 |
454.9 |
-1.8 |
0.682 |
12 |
0 |
0 |
0.315 |
13 |
|
[TRH]C:500 |
32 |
1 |
680 |
f |
C |
x,y,z |
1_555 |
66 |
30 |
13208 |
452.8 |
-2.0 |
0.707 |
12 |
0 |
0 |
0.315 |
14 |
|
[TRH]A:500 |
32 |
1 |
680 |
f |
A |
x,y,z |
1_555 |
65 |
30 |
13749 |
452.3 |
-1.7 |
0.702 |
12 |
0 |
0 |
0.315 |
15 |
|
[TRH]D:500 |
32 |
1 |
684 |
f |
D |
x,y,z |
1_555 |
64 |
30 |
13526 |
448.4 |
-2.5 |
0.721 |
9 |
0 |
0 |
0.315 |
| Average: |
453.8 |
-2.1 |
0.691 |
12 |
0 |
0 |
0.315 |
| 6 |
16 |
|
C |
52 |
17 |
13208 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
42 |
9 |
13775 |
438.9 |
-0.8 |
0.698 |
4 |
0 |
0 |
0.000 |
| 7 |
17 |
|
E |
42 |
16 |
13780 |
◊ |
A |
x,y,z |
1_555 |
42 |
16 |
13749 |
412.1 |
-6.8 |
0.123 |
0 |
0 |
0 |
0.000 |
| 8 |
18 |
|
[UMP]A:501 |
18 |
1 |
452 |
f |
A |
x,y,z |
1_555 |
42 |
17 |
13749 |
258.0 |
-1.5 |
0.584 |
4 |
0 |
0 |
0.163 |
19 |
|
[UMP]B:501 |
19 |
1 |
455 |
f |
B |
x,y,z |
1_555 |
43 |
17 |
13775 |
257.4 |
-2.0 |
0.561 |
4 |
0 |
0 |
0.163 |
20 |
|
[UMP]F:501 |
19 |
1 |
450 |
f |
F |
x,y,z |
1_555 |
43 |
17 |
13750 |
257.4 |
-2.1 |
0.565 |
4 |
0 |
0 |
0.163 |
21 |
|
[UMP]E:501 |
19 |
1 |
452 |
f |
E |
x,y,z |
1_555 |
41 |
17 |
13780 |
257.0 |
-2.1 |
0.550 |
4 |
0 |
0 |
0.163 |
22 |
|
[UMP]D:501 |
18 |
1 |
450 |
f |
D |
x,y,z |
1_555 |
40 |
16 |
13526 |
255.3 |
-2.1 |
0.621 |
4 |
0 |
0 |
0.163 |
23 |
|
[UMP]C:501 |
18 |
1 |
448 |
f |
C |
x,y,z |
1_555 |
41 |
16 |
13208 |
250.8 |
-2.0 |
0.574 |
4 |
0 |
0 |
0.163 |
| Average: |
256.0 |
-2.0 |
0.576 |
4 |
0 |
0 |
0.163 |
| 9 |
24 |
|
[UMP]E:501 |
14 |
1 |
452 |
◊ |
E |
-x,-y,z |
2_555 |
13 |
4 |
13780 |
124.0 |
-2.6 |
0.470 |
3 |
0 |
0 |
0.152 |
25 |
|
[UMP]D:501 |
14 |
1 |
450 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
13208 |
123.3 |
-2.2 |
0.513 |
3 |
0 |
0 |
0.152 |
26 |
|
[UMP]B:501 |
15 |
1 |
455 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
13749 |
123.0 |
-2.3 |
0.516 |
3 |
0 |
0 |
0.152 |
27 |
|
[UMP]F:501 |
15 |
1 |
450 |
◊ |
F |
-x,-y,z |
2_555 |
13 |
4 |
13750 |
122.0 |
-2.3 |
0.511 |
2 |
0 |
0 |
0.152 |
28 |
|
[UMP]A:501 |
14 |
1 |
452 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
13775 |
120.7 |
-2.4 |
0.485 |
3 |
0 |
0 |
0.152 |
29 |
|
[UMP]C:501 |
15 |
1 |
448 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
13526 |
120.6 |
-2.0 |
0.569 |
2 |
0 |
0 |
0.152 |
| Average: |
122.3 |
-2.3 |
0.511 |
3 |
0 |
0 |
0.152 |
| 10 |
30 |
|
D |
15 |
3 |
13526 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
10 |
4 |
13749 |
89.1 |
-1.8 |
0.331 |
0 |
0 |
0 |
0.000 |
| 11 |
31 |
|
C |
12 |
5 |
13208 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
9 |
5 |
13526 |
67.1 |
-1.4 |
0.373 |
0 |
0 |
0 |
0.000 |
| 12 |
32 |
|
D |
8 |
4 |
13526 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
11 |
3 |
13208 |
61.0 |
-0.7 |
0.448 |
0 |
0 |
0 |
0.000 |
| 13 |
33 |
|
D |
5 |
3 |
13526 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
4 |
2 |
13780 |
20.9 |
0.7 |
0.816 |
0 |
0 |
0 |
0.000 |
| 14 |
34 |
|
B |
1 |
1 |
13775 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
4 |
3 |
13526 |
20.9 |
-0.6 |
0.199 |
0 |
0 |
0 |
0.000 |
| 15 |
35 |
|
C |
4 |
2 |
13208 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
4 |
3 |
13749 |
12.4 |
0.2 |
0.689 |
0 |
0 |
0 |
0.000 |
| 16 |
36 |
|
B |
1 |
1 |
13775 |
◊ |
D |
x,y,z-1 |
1_554 |
1 |
1 |
13526 |
7.1 |
0.2 |
0.476 |
0 |
0 |
0 |
0.000 |
|