| ## |
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 |
177 |
47 |
23504 |
x |
A |
x-1,y,z |
1_455 |
155 |
41 |
23504 |
1601.4 |
-14.4 |
0.158 |
18 |
6 |
0 |
0.000 |
2 |
|
D |
163 |
43 |
23476 |
x |
D |
x-1,y,z |
1_455 |
151 |
40 |
23476 |
1587.8 |
-18.2 |
0.032 |
13 |
1 |
0 |
0.000 |
| Average: |
1594.6 |
-16.3 |
0.095 |
16 |
4 |
0 |
0.000 |
| 2 |
3 |
|
B |
128 |
32 |
11159 |
◊ |
A |
x,y,z |
1_555 |
128 |
35 |
23504 |
1195.2 |
-4.4 |
0.647 |
13 |
3 |
0 |
0.000 |
4 |
|
E |
124 |
31 |
11372 |
◊ |
D |
x,y,z |
1_555 |
125 |
35 |
23476 |
1086.8 |
-4.0 |
0.596 |
6 |
0 |
0 |
0.000 |
| Average: |
1141.0 |
-4.2 |
0.622 |
10 |
2 |
0 |
0.000 |
| 3 |
5 |
|
A |
130 |
31 |
23504 |
◊ |
F |
x,y,z-1 |
1_554 |
132 |
33 |
11453 |
1118.2 |
-4.6 |
0.598 |
13 |
0 |
0 |
0.000 |
| 4 |
6 |
|
F |
120 |
26 |
11453 |
◊ |
E |
x,y,z |
1_555 |
110 |
27 |
11372 |
1024.8 |
-8.2 |
0.326 |
9 |
6 |
0 |
0.523 |
7 |
|
C |
106 |
26 |
11186 |
◊ |
B |
x,y,z |
1_555 |
110 |
28 |
11159 |
992.8 |
-10.1 |
0.225 |
7 |
4 |
0 |
0.523 |
| Average: |
1008.8 |
-9.2 |
0.276 |
8 |
5 |
0 |
0.523 |
| 5 |
8 |
|
C |
98 |
25 |
11186 |
◊ |
D |
x,y,z |
1_555 |
97 |
26 |
23476 |
849.0 |
-1.4 |
0.699 |
11 |
2 |
0 |
0.000 |
| 6 |
9 |
|
E |
68 |
18 |
11372 |
◊ |
D |
x,y-1,z |
1_545 |
61 |
18 |
23476 |
579.3 |
2.2 |
0.778 |
5 |
0 |
0 |
0.000 |
10 |
|
B |
58 |
15 |
11159 |
◊ |
A |
x,y-1,z |
1_545 |
59 |
15 |
23504 |
518.0 |
-0.5 |
0.666 |
0 |
3 |
0 |
0.000 |
| Average: |
548.6 |
0.9 |
0.722 |
3 |
2 |
0 |
0.000 |
| 7 |
11 |
|
B |
47 |
12 |
11159 |
◊ |
C |
x,y-1,z |
1_545 |
58 |
18 |
11186 |
473.9 |
-1.7 |
0.549 |
4 |
0 |
0 |
0.000 |
12 |
|
F |
43 |
11 |
11453 |
◊ |
E |
x-1,y,z |
1_455 |
50 |
17 |
11372 |
457.2 |
-1.5 |
0.551 |
3 |
0 |
0 |
0.000 |
13 |
|
E |
39 |
8 |
11372 |
◊ |
F |
x,y-1,z |
1_545 |
50 |
17 |
11453 |
425.7 |
-2.5 |
0.411 |
2 |
0 |
0 |
0.000 |
14 |
|
C |
40 |
12 |
11186 |
◊ |
B |
x-1,y,z |
1_455 |
51 |
18 |
11159 |
409.4 |
-0.7 |
0.614 |
4 |
1 |
0 |
0.000 |
| Average: |
441.6 |
-1.6 |
0.531 |
3 |
0 |
0 |
0.000 |
| 8 |
15 |
|
D |
43 |
12 |
23476 |
◊ |
C |
x-1,y,z |
1_455 |
49 |
14 |
11186 |
398.3 |
-6.1 |
0.091 |
1 |
5 |
0 |
0.000 |
| 9 |
16 |
|
[ATP]A:602 |
30 |
1 |
590 |
f |
A |
x,y,z |
1_555 |
49 |
21 |
23504 |
333.2 |
-3.3 |
0.407 |
10 |
0 |
0 |
0.060 |
| 10 |
17 |
|
[ATP]D:602 |
28 |
1 |
554 |
f |
D |
x,y,z |
1_555 |
46 |
19 |
23476 |
332.1 |
-4.9 |
0.392 |
7 |
0 |
0 |
0.065 |
| 11 |
18 |
|
[GSH]F:301 |
19 |
1 |
512 |
f |
F |
x,y,z |
1_555 |
47 |
17 |
11453 |
294.6 |
-5.5 |
0.382 |
4 |
0 |
0 |
0.100 |
| 12 |
19 |
|
[GSH]C:301 |
20 |
1 |
506 |
f |
C |
x,y,z |
1_555 |
47 |
15 |
11186 |
280.1 |
-4.3 |
0.485 |
5 |
0 |
0 |
0.245 |
| 13 |
20 |
|
[GSH]B:301 |
19 |
1 |
503 |
f |
B |
x,y,z |
1_555 |
41 |
12 |
11159 |
272.2 |
-4.6 |
0.442 |
4 |
0 |
0 |
0.239 |
21 |
|
[GSH]E:301 |
18 |
1 |
502 |
f |
E |
x,y,z |
1_555 |
43 |
14 |
11372 |
251.5 |
-4.1 |
0.549 |
4 |
0 |
0 |
0.239 |
| Average: |
261.9 |
-4.3 |
0.496 |
4 |
0 |
0 |
0.239 |
| 14 |
22 |
|
[JAA]D:601 |
15 |
1 |
391 |
f |
D |
x,y,z |
1_555 |
36 |
18 |
23476 |
244.3 |
-4.9 |
0.229 |
0 |
0 |
0 |
0.040 |
| 15 |
23 |
|
[JAA]A:601 |
15 |
1 |
385 |
f |
A |
x,y,z |
1_555 |
40 |
18 |
23504 |
242.8 |
-4.6 |
0.252 |
2 |
0 |
0 |
0.043 |
| 16 |
24 |
|
A |
27 |
9 |
23504 |
x |
A |
x,y-1,z |
1_545 |
23 |
9 |
23504 |
208.7 |
-0.2 |
0.670 |
2 |
0 |
0 |
0.000 |
25 |
|
D |
21 |
7 |
23476 |
x |
D |
x,y-1,z |
1_545 |
17 |
8 |
23476 |
163.1 |
-0.8 |
0.541 |
0 |
0 |
0 |
0.000 |
| Average: |
185.9 |
-0.5 |
0.606 |
1 |
0 |
0 |
0.000 |
| 17 |
26 |
|
A |
12 |
5 |
23504 |
x |
A |
x-1,y-1,z |
1_445 |
11 |
4 |
23504 |
92.1 |
-0.2 |
0.603 |
1 |
1 |
0 |
0.000 |
27 |
|
D |
7 |
5 |
23476 |
x |
D |
x-1,y-1,z |
1_445 |
8 |
4 |
23476 |
66.1 |
0.2 |
0.635 |
0 |
1 |
0 |
0.000 |
| Average: |
79.1 |
-0.0 |
0.619 |
1 |
1 |
0 |
0.000 |
| 18 |
28 |
|
F |
6 |
2 |
11453 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
23476 |
72.1 |
0.7 |
0.776 |
0 |
0 |
0 |
0.000 |
29 |
|
C |
5 |
2 |
11186 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
23504 |
61.5 |
1.0 |
0.829 |
0 |
0 |
0 |
0.000 |
| Average: |
66.8 |
0.9 |
0.803 |
0 |
0 |
0 |
0.000 |
| 19 |
30 |
|
[ATP]A:602 |
9 |
1 |
590 |
f |
[JAA]A:601 |
x,y,z |
1_555 |
9 |
1 |
385 |
66.6 |
0.8 |
0.752 |
1 |
0 |
0 |
0.000 |
| 20 |
31 |
|
[ATP]D:602 |
7 |
1 |
554 |
f |
[JAA]D:601 |
x,y,z |
1_555 |
5 |
1 |
391 |
63.9 |
1.0 |
0.777 |
1 |
0 |
0 |
0.000 |
| 21 |
32 |
|
[GSH]C:301 |
3 |
1 |
506 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
11159 |
18.1 |
-0.6 |
0.283 |
0 |
0 |
0 |
0.000 |
| 22 |
33 |
|
[GSH]B:301 |
1 |
1 |
503 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
11186 |
14.7 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
| 23 |
34 |
|
[GSH]E:301 |
1 |
1 |
502 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
11453 |
11.2 |
0.2 |
0.753 |
0 |
0 |
0 |
0.000 |
35 |
|
[GSH]C:301 |
1 |
1 |
506 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11159 |
0.1 |
0.0 |
0.618 |
0 |
0 |
0 |
0.000 |
| Average: |
5.7 |
0.1 |
0.686 |
0 |
0 |
0 |
0.000 |
| 24 |
36 |
|
[GSH]F:301 |
3 |
1 |
512 |
◊ |
E |
x-1,y,z |
1_455 |
3 |
1 |
11372 |
8.7 |
-0.4 |
0.518 |
0 |
0 |
0 |
0.000 |
| 25 |
37 |
|
B |
1 |
1 |
11159 |
x |
B |
x-1,y-1,z |
1_445 |
1 |
1 |
11159 |
7.9 |
0.0 |
0.494 |
0 |
0 |
0 |
0.000 |
| 26 |
38 |
|
[GSH]B:301 |
2 |
1 |
503 |
◊ |
C |
x,y-1,z |
1_545 |
1 |
1 |
11186 |
5.9 |
-0.4 |
0.399 |
0 |
0 |
0 |
0.000 |
39 |
|
[GSH]E:301 |
1 |
1 |
502 |
◊ |
F |
x,y-1,z |
1_545 |
1 |
1 |
11453 |
0.3 |
-0.0 |
0.660 |
0 |
0 |
0 |
0.000 |
| Average: |
3.1 |
-0.2 |
0.529 |
0 |
0 |
0 |
0.000 |
| 27 |
40 |
|
[GSH]F:301 |
1 |
1 |
512 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
11372 |
2.3 |
0.0 |
0.683 |
0 |
0 |
0 |
0.000 |
|