## |
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 |
|
M |
146 |
36 |
11216 |
◊ |
B |
x,y,z |
1_555 |
162 |
48 |
14156 |
1448.0 |
-13.9 |
0.481 |
18 |
2 |
0 |
0.535 |
2 |
2 |
|
M |
103 |
27 |
11216 |
◊ |
A |
x,y,z |
1_555 |
124 |
34 |
15056 |
1115.8 |
-14.5 |
0.259 |
9 |
2 |
0 |
0.446 |
3 |
3 |
|
M |
91 |
26 |
11216 |
◊ |
C |
x,y,z |
1_555 |
113 |
38 |
14629 |
1064.3 |
-14.0 |
0.218 |
10 |
0 |
0 |
0.437 |
4 |
4 |
|
M |
73 |
17 |
11216 |
◊ |
D |
x,y,z |
1_555 |
80 |
25 |
14815 |
685.3 |
-7.6 |
0.523 |
6 |
0 |
0 |
0.000 |
5 |
5 |
|
M |
54 |
13 |
11216 |
◊ |
E |
x,y,z |
1_555 |
71 |
19 |
15004 |
606.2 |
-9.0 |
0.540 |
4 |
0 |
0 |
0.035 |
6 |
6 |
|
C |
56 |
17 |
14629 |
◊ |
A |
x-y,x,z-1/6 |
6_554 |
53 |
19 |
15056 |
467.7 |
-4.7 |
0.487 |
3 |
0 |
0 |
0.000 |
7 |
7 |
|
[ATP]A:1377 |
30 |
1 |
620 |
f |
A |
x,y,z |
1_555 |
71 |
25 |
15056 |
450.7 |
-3.1 |
0.589 |
14 |
0 |
0 |
0.251 |
8 |
|
[ATP]C:1377 |
30 |
1 |
617 |
f |
C |
x,y,z |
1_555 |
74 |
26 |
14629 |
448.0 |
-3.3 |
0.611 |
14 |
0 |
0 |
0.251 |
9 |
|
[ATP]D:1377 |
31 |
1 |
619 |
f |
D |
x,y,z |
1_555 |
71 |
26 |
14815 |
447.6 |
-3.9 |
0.603 |
14 |
0 |
0 |
0.251 |
10 |
|
[ATP]B:1377 |
30 |
1 |
622 |
f |
B |
x,y,z |
1_555 |
69 |
25 |
14156 |
446.9 |
-3.7 |
0.604 |
15 |
0 |
0 |
0.251 |
11 |
|
[ATP]E:1377 |
30 |
1 |
620 |
f |
E |
x,y,z |
1_555 |
66 |
27 |
15004 |
409.6 |
-4.7 |
0.648 |
13 |
0 |
0 |
0.251 |
Average: |
440.5 |
-3.8 |
0.611 |
14 |
0 |
0 |
0.251 |
8 |
12 |
|
[LAB]A:1376 |
24 |
1 |
556 |
f |
A |
x,y,z |
1_555 |
42 |
16 |
15056 |
363.2 |
-2.8 |
0.428 |
2 |
0 |
0 |
0.092 |
13 |
|
[LAB]C:1376 |
24 |
1 |
552 |
f |
C |
x,y,z |
1_555 |
40 |
16 |
14629 |
355.4 |
-3.0 |
0.412 |
2 |
0 |
0 |
0.092 |
Average: |
359.3 |
-2.9 |
0.420 |
2 |
0 |
0 |
0.092 |
9 |
14 |
|
D |
36 |
12 |
14815 |
◊ |
A |
x-y,x,z-1/6 |
6_554 |
37 |
10 |
15056 |
322.7 |
-0.2 |
0.658 |
4 |
1 |
0 |
0.000 |
10 |
15 |
|
C |
38 |
12 |
14629 |
◊ |
B |
x,y,z |
1_555 |
24 |
10 |
14156 |
269.7 |
-1.2 |
0.674 |
4 |
2 |
0 |
0.029 |
16 |
|
B |
17 |
7 |
14156 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
15056 |
160.2 |
-0.0 |
0.700 |
1 |
0 |
0 |
0.029 |
Average: |
214.9 |
-0.6 |
0.687 |
3 |
1 |
0 |
0.029 |
11 |
17 |
|
C |
28 |
8 |
14629 |
◊ |
C |
x,x-y-1,-z-1/6 |
12_544 |
28 |
8 |
14629 |
252.0 |
-2.3 |
0.530 |
4 |
0 |
0 |
0.000 |
12 |
18 |
|
C |
25 |
9 |
14629 |
◊ |
M |
x-y,x,z-1/6 |
6_554 |
16 |
5 |
11216 |
222.5 |
-1.4 |
0.557 |
5 |
1 |
0 |
0.000 |
13 |
19 |
|
E |
10 |
5 |
15004 |
◊ |
E |
-y-1,-x-1,-z+1/6 |
10_445 |
10 |
5 |
15004 |
123.7 |
-2.9 |
0.252 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
D |
15 |
3 |
14815 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
15056 |
104.7 |
-0.1 |
0.590 |
2 |
2 |
0 |
0.000 |
15 |
21 |
|
[ATP]A:1377 |
5 |
1 |
620 |
f |
[LAB]A:1376 |
x,y,z |
1_555 |
7 |
1 |
556 |
51.9 |
-0.9 |
0.420 |
0 |
0 |
0 |
0.022 |
22 |
|
[ATP]C:1377 |
5 |
1 |
617 |
f |
[LAB]C:1376 |
x,y,z |
1_555 |
7 |
1 |
552 |
49.5 |
-0.9 |
0.402 |
0 |
0 |
0 |
0.022 |
Average: |
50.7 |
-0.9 |
0.411 |
0 |
0 |
0 |
0.022 |
16 |
23 |
|
[MG]C:1378 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
8 |
14629 |
51.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.144 |
24 |
|
[MG]E:1378 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
14 |
8 |
15004 |
51.2 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.144 |
25 |
|
[MG]B:1378 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
14156 |
51.0 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.144 |
26 |
|
[MG]D:1378 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
8 |
14815 |
50.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.144 |
27 |
|
[MG]A:1378 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
15056 |
50.0 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.144 |
Average: |
50.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.144 |
17 |
28 |
|
A |
7 |
3 |
15056 |
◊ |
E |
x-y-1,-y-1,-z |
8_445 |
5 |
2 |
15004 |
43.7 |
-0.7 |
0.461 |
0 |
0 |
0 |
0.000 |
18 |
29 |
|
E |
5 |
2 |
15004 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
14156 |
39.8 |
-0.6 |
0.492 |
0 |
0 |
0 |
0.000 |
19 |
30 |
|
[MG]D:1378 |
1 |
1 |
98 |
f |
[ATP]D:1377 |
x,y,z |
1_555 |
5 |
1 |
619 |
31.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.086 |
31 |
|
[MG]B:1378 |
1 |
1 |
98 |
f |
[ATP]B:1377 |
x,y,z |
1_555 |
5 |
1 |
622 |
31.7 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.086 |
32 |
|
[MG]C:1378 |
1 |
1 |
98 |
f |
[ATP]C:1377 |
x,y,z |
1_555 |
5 |
1 |
617 |
31.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.086 |
33 |
|
[MG]A:1378 |
1 |
1 |
98 |
f |
[ATP]A:1377 |
x,y,z |
1_555 |
5 |
1 |
620 |
31.1 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.086 |
34 |
|
[MG]E:1378 |
1 |
1 |
98 |
f |
[ATP]E:1377 |
x,y,z |
1_555 |
5 |
1 |
620 |
30.7 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.086 |
Average: |
31.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.086 |
20 |
35 |
|
D |
3 |
3 |
14815 |
◊ |
M |
x-y,x,z-1/6 |
6_554 |
3 |
2 |
11216 |
25.4 |
-0.7 |
0.324 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
[ATP]B:1377 |
3 |
1 |
622 |
◊ |
M |
x,y,z |
1_555 |
4 |
2 |
11216 |
22.9 |
0.7 |
0.689 |
0 |
0 |
0 |
0.000 |
22 |
37 |
|
D |
1 |
1 |
14815 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
14629 |
22.9 |
-0.4 |
0.230 |
0 |
0 |
0 |
0.000 |
23 |
38 |
|
E |
1 |
1 |
15004 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14629 |
5.4 |
0.0 |
0.660 |
0 |
0 |
0 |
0.000 |
24 |
39 |
|
C |
1 |
1 |
14629 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
1 |
1 |
14156 |
4.1 |
-0.1 |
0.358 |
0 |
0 |
0 |
0.000 |
25 |
40 |
|
[ATP]B:1377 |
1 |
1 |
622 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15056 |
2.7 |
0.1 |
0.560 |
0 |
0 |
0 |
0.000 |
|