## |
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 |
822 |
207 |
54480 |
◊ |
A |
x,y,z |
1_555 |
853 |
235 |
70950 |
8106.9 |
-88.4 |
0.008 |
86 |
13 |
0 |
0.583 |
2 |
2 |
|
E |
244 |
60 |
13312 |
◊ |
A |
x,y,z |
1_555 |
270 |
80 |
70950 |
2410.2 |
-16.6 |
0.351 |
18 |
9 |
0 |
0.591 |
3 |
3 |
|
K |
201 |
46 |
8885 |
◊ |
C |
x,y,z |
1_555 |
201 |
54 |
16586 |
2061.4 |
-35.1 |
0.020 |
10 |
7 |
0 |
1.000 |
4 |
4 |
|
B |
233 |
62 |
54480 |
◊ |
B |
-x+1,-y,z |
2_655 |
234 |
62 |
54480 |
2002.3 |
-18.4 |
0.245 |
16 |
0 |
0 |
1.000 |
5 |
5 |
|
F |
193 |
50 |
5782 |
◊ |
A |
x,y,z |
1_555 |
205 |
53 |
70950 |
1871.8 |
-18.1 |
0.349 |
16 |
5 |
0 |
0.371 |
6 |
6 |
|
C |
186 |
41 |
16586 |
◊ |
B |
x,y,z |
1_555 |
185 |
48 |
54480 |
1627.2 |
-6.4 |
0.588 |
28 |
11 |
0 |
0.298 |
7 |
7 |
|
H |
171 |
40 |
8833 |
◊ |
A |
x,y,z |
1_555 |
153 |
47 |
70950 |
1564.8 |
-19.9 |
0.075 |
15 |
3 |
0 |
0.278 |
8 |
8 |
|
I |
164 |
40 |
9524 |
◊ |
A |
x,y,z |
1_555 |
166 |
42 |
70950 |
1515.9 |
-14.5 |
0.193 |
26 |
3 |
0 |
0.274 |
9 |
9 |
|
J |
141 |
32 |
4807 |
◊ |
B |
x,y,z |
1_555 |
176 |
55 |
54480 |
1491.1 |
-17.5 |
0.162 |
15 |
2 |
0 |
0.658 |
10 |
10 |
|
I |
154 |
37 |
9524 |
◊ |
B |
x,y,z |
1_555 |
149 |
36 |
54480 |
1375.5 |
-13.9 |
0.213 |
11 |
2 |
0 |
0.217 |
11 |
11 |
|
L |
95 |
25 |
4851 |
◊ |
B |
x,y,z |
1_555 |
128 |
37 |
54480 |
1113.4 |
-4.4 |
0.561 |
19 |
11 |
0 |
0.150 |
12 |
12 |
|
J |
97 |
26 |
4807 |
◊ |
C |
x,y,z |
1_555 |
110 |
35 |
16586 |
990.9 |
-5.4 |
0.563 |
10 |
8 |
0 |
0.161 |
13 |
13 |
|
K |
98 |
25 |
8885 |
◊ |
A |
x,y,z |
1_555 |
106 |
26 |
70950 |
985.5 |
-9.4 |
0.345 |
4 |
3 |
0 |
0.037 |
14 |
14 |
|
E |
74 |
20 |
13312 |
◊ |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
70 |
20 |
70950 |
574.8 |
2.4 |
0.855 |
4 |
5 |
0 |
0.000 |
15 |
15 |
|
L |
49 |
8 |
4851 |
◊ |
C |
x,y,z |
1_555 |
73 |
19 |
16586 |
541.4 |
-0.5 |
0.694 |
11 |
8 |
0 |
0.068 |
16 |
16 |
|
I |
51 |
14 |
9524 |
◊ |
A |
-x+3/2,y-1/2,-z+1/2 |
7_645 |
57 |
15 |
70950 |
511.6 |
0.6 |
0.653 |
11 |
4 |
0 |
0.000 |
17 |
17 |
|
K |
41 |
12 |
8885 |
◊ |
B |
x,y,z |
1_555 |
52 |
15 |
54480 |
450.2 |
-0.9 |
0.639 |
2 |
4 |
0 |
0.021 |
18 |
18 |
|
A |
47 |
15 |
70950 |
x |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
53 |
18 |
70950 |
441.5 |
-2.3 |
0.572 |
3 |
0 |
0 |
0.000 |
19 |
19 |
|
B |
60 |
22 |
54480 |
◊ |
A |
-x+1,-y,z |
2_655 |
40 |
14 |
70950 |
432.0 |
-3.5 |
0.444 |
4 |
0 |
0 |
0.018 |
20 |
20 |
|
C |
37 |
10 |
16586 |
◊ |
A |
-x+1,y,-z |
3_655 |
41 |
11 |
70950 |
369.6 |
-2.0 |
0.457 |
7 |
1 |
0 |
0.016 |
21 |
21 |
|
C |
40 |
11 |
16586 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
70950 |
334.3 |
-2.8 |
0.463 |
1 |
0 |
0 |
0.010 |
22 |
22 |
|
B |
34 |
11 |
54480 |
◊ |
B |
-x+2,-y,z |
2_755 |
34 |
11 |
54480 |
303.4 |
-1.0 |
0.594 |
2 |
2 |
0 |
0.000 |
23 |
23 |
|
K |
19 |
7 |
8885 |
◊ |
H |
x,y,z |
1_555 |
21 |
7 |
8833 |
205.3 |
-1.4 |
0.494 |
0 |
0 |
0 |
0.004 |
24 |
24 |
|
K |
21 |
5 |
8885 |
◊ |
C |
-x+2,y,-z |
3_755 |
27 |
6 |
16586 |
197.1 |
-2.0 |
0.496 |
0 |
0 |
0 |
0.000 |
25 |
25 |
|
E |
29 |
7 |
13312 |
◊ |
I |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
24 |
7 |
9524 |
193.3 |
-0.8 |
0.516 |
0 |
0 |
0 |
0.000 |
26 |
26 |
|
[ATP]A:3011 |
24 |
1 |
623 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
54480 |
190.7 |
1.4 |
0.685 |
2 |
0 |
0 |
0.000 |
27 |
27 |
|
H |
18 |
5 |
8833 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
16586 |
164.0 |
-1.4 |
0.399 |
0 |
1 |
0 |
0.004 |
28 |
28 |
|
F |
19 |
6 |
5782 |
◊ |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
15 |
3 |
70950 |
157.5 |
-1.2 |
0.539 |
0 |
0 |
0 |
0.000 |
29 |
29 |
|
L |
16 |
4 |
4851 |
◊ |
L |
-x+1,y,-z |
3_655 |
16 |
4 |
4851 |
151.9 |
-0.1 |
0.611 |
2 |
0 |
0 |
0.001 |
30 |
30 |
|
A |
22 |
7 |
70950 |
◊ |
E |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
16 |
7 |
13312 |
143.0 |
-1.0 |
0.511 |
0 |
1 |
0 |
0.000 |
31 |
31 |
|
F |
15 |
5 |
5782 |
◊ |
B |
x,y,z |
1_555 |
18 |
9 |
54480 |
139.5 |
0.6 |
0.758 |
1 |
0 |
0 |
0.000 |
32 |
32 |
|
L |
18 |
6 |
4851 |
◊ |
B |
-x+1,y,-z |
3_655 |
14 |
5 |
54480 |
135.2 |
0.0 |
0.628 |
4 |
1 |
0 |
0.006 |
33 |
33 |
|
[ATP]A:3011 |
21 |
1 |
623 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
70950 |
125.2 |
-1.7 |
0.514 |
0 |
0 |
0 |
0.039 |
34 |
34 |
|
F |
14 |
5 |
5782 |
◊ |
E |
x,y,z |
1_555 |
11 |
4 |
13312 |
103.5 |
-0.0 |
0.651 |
0 |
1 |
0 |
0.003 |
35 |
35 |
|
L |
14 |
5 |
4851 |
◊ |
L |
-x+1,-y,z |
2_655 |
13 |
5 |
4851 |
88.8 |
-1.1 |
0.478 |
0 |
0 |
0 |
0.005 |
36 |
36 |
|
B |
13 |
4 |
54480 |
◊ |
E |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
6 |
2 |
13312 |
87.5 |
-1.1 |
0.266 |
0 |
0 |
0 |
0.000 |
37 |
37 |
|
C |
8 |
4 |
16586 |
◊ |
B |
-x+1,y,-z |
3_655 |
7 |
3 |
54480 |
63.8 |
0.8 |
0.744 |
0 |
0 |
0 |
0.000 |
38 |
38 |
|
B |
5 |
3 |
54480 |
◊ |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
4 |
2 |
70950 |
53.6 |
-0.6 |
0.381 |
0 |
0 |
0 |
0.000 |
39 |
39 |
|
L |
2 |
1 |
4851 |
◊ |
L |
x,-y,-z |
4_555 |
2 |
1 |
4851 |
42.9 |
-1.4 |
0.107 |
0 |
0 |
0 |
0.002 |
40 |
40 |
|
[MN]A:3009 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
70950 |
40.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.060 |
41 |
41 |
|
[ATP]A:3011 |
5 |
1 |
623 |
cf |
[MN]A:3010 |
x,y,z |
1_555 |
1 |
1 |
123 |
39.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.078 |
42 |
42 |
|
[ATP]A:3011 |
3 |
1 |
623 |
f |
[MN]A:3009 |
x,y,z |
1_555 |
1 |
1 |
123 |
38.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.061 |
43 |
43 |
|
[MN]A:3010 |
1 |
1 |
123 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
54480 |
34.0 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
44 |
|
[MN]A:3009 |
1 |
1 |
123 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
54480 |
12.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.008 |
Average: |
23.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.008 |
44 |
45 |
|
[MN]A:3010 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
70950 |
31.9 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.028 |
45 |
46 |
|
B |
3 |
1 |
54480 |
◊ |
B |
-x+1,y,-z |
3_655 |
3 |
1 |
54480 |
23.3 |
0.6 |
0.842 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
A |
2 |
2 |
70950 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
1 |
54480 |
18.9 |
0.6 |
0.733 |
0 |
0 |
0 |
0.000 |
47 |
48 |
|
E |
2 |
1 |
13312 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
54480 |
15.4 |
0.7 |
0.866 |
0 |
0 |
0 |
0.000 |
48 |
49 |
|
L |
1 |
1 |
4851 |
◊ |
B |
-x+1,-y,z |
2_655 |
1 |
1 |
54480 |
15.1 |
-0.1 |
0.443 |
0 |
0 |
0 |
0.000 |
49 |
50 |
|
[MN]A:3010 |
1 |
1 |
123 |
f |
[MN]A:3009 |
x,y,z |
1_555 |
1 |
1 |
123 |
14.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.033 |
50 |
51 |
|
L |
1 |
1 |
4851 |
◊ |
K |
x,y,z |
1_555 |
2 |
1 |
8885 |
14.3 |
-0.1 |
0.556 |
0 |
0 |
0 |
0.000 |
51 |
52 |
|
[ZN]C:3002 |
1 |
1 |
98 |
f |
A |
-x+1,y,-z |
3_655 |
1 |
1 |
70950 |
11.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.093 |
52 |
53 |
|
L |
2 |
2 |
4851 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
4807 |
6.8 |
0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
53 |
54 |
|
C |
1 |
1 |
16586 |
◊ |
C |
-x+2,y,-z |
3_755 |
1 |
1 |
16586 |
3.8 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
54 |
55 |
|
[ZN]B:3007 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
70950 |
2.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.018 |
55 |
56 |
|
H |
1 |
1 |
8833 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54480 |
1.4 |
-0.1 |
0.428 |
0 |
0 |
0 |
0.000 |
|