## |
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 |
325 |
88 |
22367 |
◊ |
A |
x,y,z |
1_555 |
326 |
87 |
22343 |
3239.9 |
-30.6 |
0.089 |
50 |
6 |
0 |
0.525 |
2 |
|
D |
326 |
88 |
22328 |
◊ |
C |
x,y,z |
1_555 |
321 |
88 |
22341 |
3225.8 |
-30.5 |
0.086 |
50 |
7 |
0 |
0.525 |
Average: |
3232.8 |
-30.5 |
0.088 |
50 |
7 |
0 |
0.525 |
2 |
3 |
|
C |
129 |
37 |
22341 |
◊ |
B |
x,y,z |
1_555 |
129 |
38 |
22367 |
1261.6 |
-11.8 |
0.225 |
14 |
4 |
0 |
0.268 |
4 |
|
D |
131 |
38 |
22328 |
◊ |
A |
x,y,z |
1_555 |
131 |
38 |
22343 |
1250.5 |
-11.6 |
0.241 |
14 |
4 |
0 |
0.268 |
Average: |
1256.0 |
-11.7 |
0.233 |
14 |
4 |
0 |
0.268 |
3 |
5 |
|
C |
52 |
19 |
22341 |
◊ |
A |
x,y,z |
1_555 |
53 |
19 |
22343 |
532.0 |
-6.6 |
0.182 |
6 |
8 |
0 |
0.076 |
6 |
|
D |
52 |
18 |
22328 |
◊ |
B |
x,y,z |
1_555 |
52 |
19 |
22367 |
528.6 |
-6.1 |
0.207 |
6 |
6 |
0 |
0.076 |
Average: |
530.3 |
-6.3 |
0.194 |
6 |
7 |
0 |
0.076 |
4 |
7 |
|
B |
52 |
20 |
22367 |
◊ |
B |
x-y,-y,-z-1/3 |
5_554 |
52 |
20 |
22367 |
514.7 |
1.9 |
0.871 |
12 |
4 |
0 |
0.000 |
5 |
8 |
|
D |
45 |
21 |
22328 |
◊ |
D |
x-y,-y,-z+2/3 |
5_555 |
45 |
21 |
22328 |
405.1 |
-2.5 |
0.501 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
35 |
12 |
22343 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
35 |
12 |
22343 |
330.5 |
1.9 |
0.870 |
4 |
4 |
0 |
0.000 |
7 |
10 |
|
[TPP]A:602 |
25 |
1 |
598 |
f |
A |
x,y,z |
1_555 |
50 |
19 |
22343 |
323.7 |
-8.6 |
0.420 |
13 |
0 |
0 |
0.418 |
11 |
|
[TPP]B:612 |
25 |
1 |
596 |
f |
B |
x,y,z |
1_555 |
47 |
19 |
22367 |
321.4 |
-9.3 |
0.400 |
13 |
0 |
0 |
0.418 |
12 |
|
[TPP]D:632 |
26 |
1 |
597 |
f |
D |
x,y,z |
1_555 |
47 |
20 |
22328 |
321.0 |
-8.9 |
0.430 |
12 |
0 |
0 |
0.418 |
13 |
|
[TPP]C:622 |
26 |
1 |
597 |
f |
C |
x,y,z |
1_555 |
45 |
19 |
22341 |
320.5 |
-8.7 |
0.423 |
12 |
0 |
0 |
0.418 |
Average: |
321.7 |
-8.9 |
0.418 |
13 |
0 |
0 |
0.418 |
8 |
14 |
|
D |
37 |
14 |
22328 |
◊ |
C |
-x+1,-x+y,-z+1/3 |
6_655 |
34 |
13 |
22341 |
314.9 |
0.9 |
0.797 |
2 |
3 |
0 |
0.000 |
9 |
15 |
|
A |
26 |
8 |
22343 |
◊ |
C |
-x+1,-x+y,-z+1/3 |
6_655 |
27 |
10 |
22341 |
261.2 |
-0.4 |
0.594 |
0 |
4 |
0 |
0.000 |
10 |
16 |
|
A |
32 |
11 |
22343 |
◊ |
B |
y,x-1,-z |
4_545 |
27 |
11 |
22367 |
254.1 |
0.1 |
0.708 |
2 |
3 |
0 |
0.000 |
11 |
17 |
|
A |
29 |
11 |
22343 |
◊ |
C |
y,x-1,-z |
4_545 |
27 |
9 |
22341 |
252.5 |
-0.1 |
0.692 |
1 |
3 |
0 |
0.000 |
12 |
18 |
|
[TPP]C:622 |
13 |
1 |
597 |
◊ |
D |
x,y,z |
1_555 |
24 |
11 |
22328 |
144.5 |
1.3 |
0.765 |
1 |
0 |
0 |
0.000 |
19 |
|
[TPP]D:632 |
13 |
1 |
597 |
◊ |
C |
x,y,z |
1_555 |
22 |
11 |
22341 |
142.6 |
1.2 |
0.753 |
1 |
0 |
0 |
0.000 |
20 |
|
[TPP]A:602 |
13 |
1 |
598 |
◊ |
B |
x,y,z |
1_555 |
24 |
11 |
22367 |
141.2 |
1.2 |
0.751 |
0 |
0 |
0 |
0.000 |
21 |
|
[TPP]B:612 |
13 |
1 |
596 |
◊ |
A |
x,y,z |
1_555 |
21 |
11 |
22343 |
140.6 |
1.3 |
0.762 |
2 |
0 |
0 |
0.000 |
Average: |
142.2 |
1.2 |
0.758 |
1 |
0 |
0 |
0.000 |
13 |
22 |
|
C |
9 |
5 |
22341 |
◊ |
C |
y,x,-z |
4_555 |
9 |
5 |
22341 |
63.0 |
1.5 |
0.892 |
0 |
0 |
0 |
0.000 |
14 |
23 |
|
[MG]C:621 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
8 |
22341 |
37.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.175 |
24 |
|
[MG]B:611 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
22367 |
37.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.175 |
25 |
|
[MG]D:631 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
10 |
8 |
22328 |
37.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.175 |
26 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
22343 |
37.2 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.175 |
Average: |
37.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.175 |
15 |
27 |
|
A |
6 |
3 |
22343 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
6 |
3 |
22367 |
32.1 |
-0.4 |
0.477 |
0 |
0 |
0 |
0.000 |
16 |
28 |
|
[TPP]A:602 |
4 |
1 |
598 |
f |
[MG]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.3 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.142 |
29 |
|
[TPP]B:612 |
4 |
1 |
596 |
f |
[MG]B:611 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.142 |
30 |
|
[TPP]D:632 |
4 |
1 |
597 |
f |
[MG]D:631 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.142 |
31 |
|
[TPP]C:622 |
4 |
1 |
597 |
f |
[MG]C:621 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.142 |
Average: |
30.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.142 |
|