| ## |
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 |
|
K |
194 |
44 |
9959 |
◊ |
I |
x,y,z |
1_555 |
196 |
48 |
15974 |
1948.3 |
-37.6 |
0.035 |
10 |
10 |
0 |
1.000 |
2 |
|
F |
195 |
44 |
9966 |
◊ |
D |
x,y,z |
1_555 |
193 |
48 |
15957 |
1939.0 |
-37.5 |
0.033 |
10 |
10 |
0 |
1.000 |
| Average: |
1943.6 |
-37.6 |
0.034 |
10 |
10 |
0 |
1.000 |
| 2 |
3 |
|
I |
157 |
38 |
15974 |
◊ |
B |
x,y,z |
1_555 |
148 |
38 |
17119 |
1440.4 |
-6.3 |
0.848 |
19 |
11 |
0 |
0.758 |
4 |
|
D |
161 |
38 |
15957 |
◊ |
A |
x,y,z |
1_555 |
144 |
39 |
17109 |
1420.1 |
-5.8 |
0.861 |
19 |
13 |
0 |
0.758 |
| Average: |
1430.2 |
-6.0 |
0.855 |
19 |
12 |
0 |
0.758 |
| 3 |
5 |
|
K |
94 |
28 |
9959 |
◊ |
H |
x,y,z |
1_555 |
98 |
35 |
15404 |
941.2 |
-7.7 |
0.558 |
9 |
0 |
0 |
0.439 |
6 |
|
F |
97 |
29 |
9966 |
◊ |
C |
x,y,z |
1_555 |
96 |
35 |
15379 |
940.1 |
-7.8 |
0.573 |
7 |
0 |
0 |
0.439 |
| Average: |
940.7 |
-7.8 |
0.566 |
8 |
0 |
0 |
0.439 |
| 4 |
7 |
|
G |
76 |
21 |
6738 |
◊ |
F |
x,y,z |
1_555 |
77 |
21 |
9966 |
725.0 |
-9.7 |
0.381 |
5 |
0 |
0 |
1.000 |
8 |
|
L |
76 |
21 |
6737 |
◊ |
K |
x,y,z |
1_555 |
77 |
21 |
9959 |
712.7 |
-9.7 |
0.381 |
4 |
0 |
0 |
1.000 |
| Average: |
718.9 |
-9.7 |
0.381 |
5 |
0 |
0 |
1.000 |
| 5 |
9 |
|
C |
61 |
25 |
15379 |
◊ |
B |
x,y,z |
1_555 |
81 |
28 |
17119 |
670.3 |
-5.2 |
0.550 |
5 |
0 |
0 |
0.075 |
10 |
|
H |
63 |
25 |
15404 |
◊ |
A |
x,y,z |
1_555 |
78 |
26 |
17109 |
663.4 |
-5.1 |
0.560 |
6 |
0 |
0 |
0.075 |
| Average: |
666.8 |
-5.1 |
0.555 |
6 |
0 |
0 |
0.075 |
| 6 |
11 |
|
J |
44 |
13 |
5113 |
◊ |
B |
x,y,z |
1_555 |
48 |
19 |
17119 |
447.5 |
-7.4 |
0.312 |
1 |
0 |
0 |
0.000 |
12 |
|
E |
42 |
12 |
5122 |
◊ |
A |
x,y,z |
1_555 |
43 |
18 |
17109 |
431.4 |
-7.4 |
0.260 |
1 |
0 |
0 |
0.000 |
| Average: |
439.4 |
-7.4 |
0.286 |
1 |
0 |
0 |
0.000 |
| 7 |
13 |
|
A |
54 |
15 |
17109 |
◊ |
A |
x,-y-1,-z |
6_545 |
54 |
15 |
17109 |
416.8 |
-3.6 |
0.546 |
0 |
0 |
0 |
0.000 |
| 8 |
14 |
|
[ATP]B:428 |
30 |
1 |
630 |
f |
B |
x,y,z |
1_555 |
63 |
21 |
17119 |
391.9 |
-3.2 |
0.546 |
6 |
0 |
0 |
0.263 |
15 |
|
[ATP]A:428 |
30 |
1 |
634 |
f |
A |
x,y,z |
1_555 |
60 |
21 |
17109 |
389.0 |
-2.9 |
0.563 |
5 |
0 |
0 |
0.263 |
| Average: |
390.4 |
-3.1 |
0.554 |
6 |
0 |
0 |
0.263 |
| 9 |
16 |
|
G |
39 |
12 |
6738 |
◊ |
I |
y+1,x-1,-z-1/2 |
7_644 |
47 |
12 |
15974 |
374.2 |
-4.0 |
0.525 |
2 |
0 |
0 |
0.000 |
| 10 |
17 |
|
L |
27 |
10 |
6737 |
◊ |
H |
x,y,z |
1_555 |
39 |
14 |
15404 |
315.4 |
-2.2 |
0.661 |
3 |
0 |
0 |
0.133 |
18 |
|
G |
27 |
10 |
6738 |
◊ |
C |
x,y,z |
1_555 |
37 |
13 |
15379 |
309.7 |
-2.2 |
0.656 |
3 |
0 |
0 |
0.133 |
| Average: |
312.6 |
-2.2 |
0.658 |
3 |
0 |
0 |
0.133 |
| 11 |
19 |
|
D |
25 |
10 |
15957 |
◊ |
D |
-x+1,y,-z |
5_655 |
25 |
10 |
15957 |
224.7 |
-2.6 |
0.550 |
2 |
0 |
0 |
0.000 |
| 12 |
20 |
|
D |
22 |
8 |
15957 |
◊ |
H |
x,y,z |
1_555 |
20 |
7 |
15404 |
184.4 |
-1.3 |
0.442 |
0 |
0 |
0 |
0.012 |
21 |
|
I |
22 |
8 |
15974 |
◊ |
C |
x,y,z |
1_555 |
17 |
7 |
15379 |
162.7 |
-1.1 |
0.446 |
0 |
0 |
0 |
0.012 |
| Average: |
173.6 |
-1.2 |
0.444 |
0 |
0 |
0 |
0.012 |
| 13 |
22 |
|
K |
16 |
7 |
9959 |
◊ |
B |
x,y,z |
1_555 |
17 |
8 |
17119 |
162.3 |
0.6 |
0.673 |
1 |
3 |
0 |
0.004 |
23 |
|
F |
14 |
6 |
9966 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
17109 |
145.5 |
0.6 |
0.655 |
1 |
3 |
0 |
0.004 |
| Average: |
153.9 |
0.6 |
0.664 |
1 |
3 |
0 |
0.004 |
| 14 |
24 |
|
L |
21 |
12 |
6737 |
◊ |
B |
-y,-x,-z-1/2 |
8_554 |
23 |
10 |
17119 |
154.8 |
-2.4 |
0.459 |
0 |
0 |
0 |
0.000 |
| 15 |
25 |
|
F |
9 |
3 |
9966 |
◊ |
A |
x,-y-1,-z |
6_545 |
10 |
4 |
17109 |
108.3 |
-1.2 |
0.390 |
2 |
0 |
0 |
0.000 |
| 16 |
26 |
|
J |
4 |
2 |
5113 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
15379 |
61.9 |
0.6 |
0.644 |
0 |
0 |
0 |
0.000 |
27 |
|
E |
4 |
2 |
5122 |
◊ |
H |
x,y,z |
1_555 |
7 |
3 |
15404 |
57.9 |
0.7 |
0.639 |
0 |
0 |
0 |
0.000 |
| Average: |
59.9 |
0.6 |
0.642 |
0 |
0 |
0 |
0.000 |
| 17 |
28 |
|
D |
3 |
2 |
15957 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
15379 |
15.5 |
-0.2 |
0.533 |
0 |
0 |
0 |
0.003 |
29 |
|
I |
2 |
1 |
15974 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
15404 |
14.7 |
-0.2 |
0.447 |
0 |
0 |
0 |
0.003 |
| Average: |
15.1 |
-0.2 |
0.490 |
0 |
0 |
0 |
0.003 |
| 18 |
30 |
|
K |
1 |
1 |
9959 |
◊ |
I |
-y,-x,-z-1/2 |
8_554 |
1 |
1 |
15974 |
0.9 |
-0.0 |
0.571 |
0 |
0 |
0 |
0.000 |
|