## |
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 |
121 |
34 |
10238 |
◊ |
A |
x,y,z |
1_555 |
121 |
35 |
10177 |
1188.3 |
-17.5 |
0.117 |
18 |
4 |
0 |
0.175 |
2 |
2 |
|
[GVX]A:301 |
29 |
1 |
660 |
f |
A |
x,y,z |
1_555 |
53 |
17 |
10177 |
405.5 |
-6.8 |
0.729 |
10 |
0 |
0 |
0.151 |
3 |
|
[GVX]B:301 |
28 |
1 |
660 |
f |
B |
x,y,z |
1_555 |
55 |
18 |
10238 |
401.1 |
-6.8 |
0.708 |
10 |
0 |
0 |
0.151 |
Average: |
403.3 |
-6.8 |
0.718 |
10 |
0 |
0 |
0.151 |
3 |
4 |
|
A |
32 |
10 |
10177 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
25 |
10 |
10238 |
291.0 |
-2.3 |
0.511 |
4 |
0 |
0 |
0.000 |
5 |
|
A |
28 |
12 |
10177 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
31 |
10 |
10238 |
290.3 |
-2.5 |
0.493 |
4 |
0 |
0 |
0.000 |
Average: |
290.7 |
-2.4 |
0.502 |
4 |
0 |
0 |
0.000 |
4 |
6 |
|
[GSH]A:308 |
17 |
1 |
502 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
10177 |
178.6 |
-1.8 |
0.720 |
3 |
0 |
0 |
0.021 |
5 |
7 |
|
B |
16 |
5 |
10238 |
◊ |
B |
-x,y,-z |
2_555 |
16 |
5 |
10238 |
162.4 |
2.8 |
0.952 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
[GSH]A:308 |
14 |
1 |
502 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
10238 |
157.0 |
-4.9 |
0.515 |
2 |
0 |
0 |
0.039 |
7 |
9 |
|
[MPD]B:302 |
6 |
1 |
276 |
f |
B |
x,y,z |
1_555 |
23 |
7 |
10238 |
139.2 |
-9.4 |
0.579 |
1 |
0 |
0 |
0.127 |
10 |
|
[MPD]A:302 |
7 |
1 |
271 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
10177 |
138.0 |
-9.1 |
0.617 |
0 |
0 |
0 |
0.127 |
Average: |
138.6 |
-9.2 |
0.598 |
1 |
0 |
0 |
0.127 |
8 |
11 |
|
A |
10 |
3 |
10177 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
10 |
3 |
10177 |
122.5 |
1.1 |
0.861 |
4 |
4 |
0 |
0.000 |
9 |
12 |
|
[MPD]B:302 |
6 |
1 |
276 |
f |
[GVX]B:301 |
x,y,z |
1_555 |
12 |
1 |
660 |
88.5 |
-4.9 |
0.956 |
0 |
0 |
0 |
0.033 |
10 |
13 |
|
[ACT]B:303 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
10238 |
87.3 |
-0.6 |
0.651 |
2 |
0 |
0 |
0.010 |
11 |
14 |
|
[ACT]A:303 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10177 |
86.0 |
-0.7 |
0.647 |
2 |
0 |
0 |
0.010 |
12 |
15 |
|
[MPD]A:302 |
6 |
1 |
271 |
f |
[GVX]A:301 |
x,y,z |
1_555 |
12 |
1 |
660 |
84.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.032 |
13 |
16 |
|
B |
9 |
3 |
10238 |
◊ |
A |
-x,y,-z |
2_555 |
7 |
2 |
10177 |
73.5 |
0.2 |
0.723 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[CA]A:305 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
10177 |
44.4 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.121 |
18 |
|
[CA]B:305 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
10238 |
44.3 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.121 |
Average: |
44.3 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.121 |
15 |
19 |
|
B |
3 |
2 |
10238 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
6 |
2 |
10177 |
44.1 |
-1.0 |
0.280 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
A |
12 |
5 |
10177 |
◊ |
A |
-x,y,-z |
2_555 |
12 |
5 |
10177 |
43.0 |
-0.8 |
0.562 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
B |
7 |
2 |
10238 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
7 |
2 |
10238 |
42.0 |
-1.0 |
0.405 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[CA]B:307 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
10238 |
40.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.112 |
23 |
|
[CA]A:307 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
10177 |
39.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
39.9 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.112 |
19 |
24 |
|
[CA]B:304 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10238 |
39.4 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.089 |
25 |
|
[CA]A:304 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
10177 |
39.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.089 |
Average: |
39.4 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.089 |
20 |
26 |
|
[GVX]B:301 |
3 |
1 |
660 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10177 |
39.1 |
0.6 |
0.822 |
1 |
0 |
0 |
0.000 |
27 |
|
[GVX]A:301 |
3 |
1 |
660 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
10238 |
37.7 |
0.6 |
0.826 |
1 |
0 |
0 |
0.000 |
Average: |
38.4 |
0.6 |
0.824 |
1 |
0 |
0 |
0.000 |
21 |
28 |
|
B |
4 |
1 |
10238 |
◊ |
B |
-x,y,-z+1 |
2_556 |
4 |
1 |
10238 |
35.5 |
0.5 |
0.810 |
0 |
0 |
0 |
0.000 |
22 |
29 |
|
A |
2 |
1 |
10177 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
5 |
2 |
10238 |
34.9 |
-0.6 |
0.260 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[CA]B:306 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
10238 |
33.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
|
[CA]A:306 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10177 |
33.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
33.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
32 |
|
[CA]A:306 |
1 |
1 |
85 |
f |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
3 |
10238 |
32.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.077 |
33 |
|
A |
6 |
3 |
10177 |
f |
[CA]B:306 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
85 |
31.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.077 |
Average: |
31.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.077 |
25 |
34 |
|
[CA]A:304 |
1 |
1 |
85 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
7 |
2 |
10238 |
29.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
A |
5 |
2 |
10177 |
◊ |
[CA]B:304 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
85 |
28.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
29.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
36 |
|
[CA]A:307 |
1 |
1 |
85 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
10177 |
5.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
37 |
|
A |
2 |
1 |
10177 |
◊ |
[CA]B:307 |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
85 |
5.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
[CA]B:305 |
1 |
1 |
85 |
f |
[ACT]B:303 |
x,y,z |
1_555 |
1 |
1 |
182 |
2.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.003 |
29 |
39 |
|
[CA]A:305 |
1 |
1 |
85 |
f |
[ACT]A:303 |
x,y,z |
1_555 |
1 |
1 |
181 |
2.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.003 |
|