## |
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 |
|
F |
191 |
54 |
13983 |
◊ |
D |
x,y,z |
1_555 |
193 |
52 |
13846 |
1822.3 |
-14.4 |
0.143 |
13 |
1 |
0 |
0.452 |
2 |
|
E |
192 |
50 |
13807 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
195 |
52 |
13787 |
1803.4 |
-16.4 |
0.101 |
12 |
1 |
0 |
0.452 |
3 |
|
B |
186 |
54 |
13855 |
◊ |
C |
x-1,y,z |
1_455 |
190 |
51 |
13675 |
1792.3 |
-15.9 |
0.106 |
13 |
0 |
0 |
0.452 |
Average: |
1806.0 |
-15.5 |
0.117 |
13 |
1 |
0 |
0.452 |
2 |
4 |
|
[NDP]A:1500 |
45 |
1 |
896 |
f |
A |
x,y,z |
1_555 |
74 |
26 |
13787 |
541.0 |
-3.8 |
0.437 |
17 |
0 |
0 |
0.480 |
5 |
|
[NDP]C:3500 |
46 |
1 |
888 |
f |
C |
x,y,z |
1_555 |
76 |
26 |
13675 |
539.1 |
-3.4 |
0.475 |
17 |
0 |
0 |
0.480 |
6 |
|
[NDP]B:2500 |
45 |
1 |
893 |
f |
B |
x,y,z |
1_555 |
78 |
27 |
13855 |
537.7 |
-3.1 |
0.465 |
19 |
0 |
0 |
0.480 |
7 |
|
[NDP]E:5500 |
46 |
1 |
886 |
f |
E |
x,y,z |
1_555 |
75 |
26 |
13807 |
534.8 |
-3.3 |
0.465 |
18 |
0 |
0 |
0.480 |
8 |
|
[NDP]F:6500 |
46 |
1 |
893 |
f |
F |
x,y,z |
1_555 |
71 |
26 |
13983 |
532.6 |
-2.9 |
0.488 |
19 |
0 |
0 |
0.480 |
9 |
|
[NDP]D:4500 |
45 |
1 |
890 |
f |
D |
x,y,z |
1_555 |
75 |
27 |
13846 |
531.3 |
-2.6 |
0.489 |
17 |
0 |
0 |
0.480 |
Average: |
536.1 |
-3.2 |
0.470 |
18 |
0 |
0 |
0.480 |
3 |
10 |
|
B |
50 |
16 |
13855 |
◊ |
A |
x,y,z |
1_555 |
51 |
16 |
13787 |
535.3 |
0.7 |
0.700 |
12 |
0 |
0 |
0.000 |
11 |
|
F |
50 |
17 |
13983 |
◊ |
C |
x,y,z |
1_555 |
52 |
18 |
13675 |
499.5 |
-0.0 |
0.649 |
10 |
0 |
0 |
0.000 |
12 |
|
E |
52 |
15 |
13807 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
51 |
16 |
13846 |
488.4 |
0.2 |
0.672 |
7 |
0 |
0 |
0.000 |
Average: |
507.7 |
0.3 |
0.674 |
10 |
0 |
0 |
0.000 |
4 |
13 |
|
E |
37 |
11 |
13807 |
◊ |
A |
x,y,z |
1_555 |
47 |
14 |
13787 |
414.9 |
-1.8 |
0.462 |
4 |
0 |
0 |
0.000 |
5 |
14 |
|
F |
34 |
11 |
13983 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
32 |
7 |
13675 |
303.2 |
-3.3 |
0.257 |
1 |
1 |
0 |
0.000 |
6 |
15 |
|
C |
35 |
14 |
13675 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
13787 |
238.7 |
-0.2 |
0.578 |
3 |
0 |
0 |
0.000 |
7 |
16 |
|
B |
23 |
8 |
13855 |
◊ |
A |
x-1,y,z |
1_455 |
25 |
9 |
13787 |
204.9 |
-0.5 |
0.542 |
2 |
0 |
0 |
0.000 |
8 |
17 |
|
B |
18 |
7 |
13855 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
16 |
6 |
13855 |
151.8 |
-0.2 |
0.561 |
1 |
1 |
0 |
0.000 |
9 |
18 |
|
E |
13 |
5 |
13807 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
13675 |
106.6 |
-0.3 |
0.561 |
1 |
2 |
0 |
0.000 |
10 |
19 |
|
B |
17 |
6 |
13855 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
14 |
7 |
13787 |
105.4 |
0.2 |
0.570 |
0 |
0 |
0 |
0.000 |
11 |
20 |
|
[ACT]F:6502 |
4 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
21 |
10 |
13983 |
105.2 |
-1.0 |
0.496 |
1 |
0 |
0 |
0.032 |
12 |
21 |
|
[ACT]E:5502 |
4 |
1 |
183 |
f |
E |
x,y,z |
1_555 |
24 |
12 |
13807 |
104.1 |
0.1 |
0.720 |
3 |
0 |
0 |
0.026 |
13 |
22 |
|
[ACT]D:4502 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
20 |
8 |
13846 |
103.6 |
0.9 |
0.836 |
3 |
0 |
0 |
0.010 |
14 |
23 |
|
[ACT]A:1502 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
13787 |
102.5 |
-0.4 |
0.671 |
3 |
0 |
0 |
0.052 |
24 |
|
[ACT]C:3502 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
20 |
10 |
13675 |
101.0 |
-0.7 |
0.612 |
1 |
0 |
0 |
0.052 |
25 |
|
[ACT]B:2502 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
22 |
10 |
13855 |
100.8 |
-0.0 |
0.710 |
3 |
0 |
0 |
0.052 |
Average: |
101.4 |
-0.4 |
0.665 |
2 |
0 |
0 |
0.052 |
15 |
26 |
|
F |
8 |
4 |
13983 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
13807 |
75.0 |
-0.7 |
0.361 |
0 |
0 |
0 |
0.000 |
16 |
27 |
|
B |
8 |
2 |
13855 |
◊ |
E |
x-1,y,z |
1_455 |
8 |
3 |
13807 |
60.8 |
-1.3 |
0.249 |
0 |
0 |
0 |
0.000 |
17 |
28 |
|
[NDP]C:3500 |
10 |
1 |
888 |
f |
[ACT]C:3502 |
x,y,z |
1_555 |
4 |
1 |
182 |
53.0 |
-0.7 |
0.588 |
0 |
0 |
0 |
0.031 |
29 |
|
[NDP]A:1500 |
10 |
1 |
896 |
f |
[ACT]A:1502 |
x,y,z |
1_555 |
4 |
1 |
183 |
53.0 |
-0.8 |
0.564 |
0 |
0 |
0 |
0.031 |
30 |
|
[NDP]B:2500 |
11 |
1 |
893 |
f |
[ACT]B:2502 |
x,y,z |
1_555 |
4 |
1 |
183 |
51.7 |
-0.8 |
0.574 |
0 |
0 |
0 |
0.031 |
Average: |
52.6 |
-0.8 |
0.576 |
0 |
0 |
0 |
0.031 |
18 |
31 |
|
[NDP]E:5500 |
11 |
1 |
886 |
f |
[ACT]E:5502 |
x,y,z |
1_555 |
4 |
1 |
183 |
52.5 |
-0.7 |
0.570 |
0 |
0 |
0 |
0.015 |
19 |
32 |
|
[NDP]D:4500 |
10 |
1 |
890 |
f |
[ACT]D:4502 |
x,y,z |
1_555 |
4 |
1 |
184 |
49.8 |
-0.6 |
0.566 |
0 |
0 |
0 |
0.013 |
20 |
33 |
|
[NDP]F:6500 |
8 |
1 |
893 |
f |
[ACT]F:6502 |
x,y,z |
1_555 |
4 |
1 |
183 |
49.6 |
-0.5 |
0.590 |
0 |
0 |
0 |
0.012 |
21 |
34 |
|
B |
6 |
2 |
13855 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
3 |
13675 |
46.9 |
-0.1 |
0.470 |
0 |
0 |
0 |
0.000 |
35 |
|
E |
2 |
1 |
13807 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
13846 |
16.3 |
-0.0 |
0.430 |
0 |
0 |
0 |
0.000 |
Average: |
31.6 |
-0.1 |
0.450 |
0 |
0 |
0 |
0.000 |
22 |
36 |
|
D |
5 |
1 |
13846 |
x |
D |
-x,y-1/2,-z |
2_545 |
1 |
1 |
13846 |
11.4 |
0.3 |
0.762 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
5 |
2 |
13787 |
x |
C |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
13675 |
9.2 |
0.2 |
0.716 |
0 |
0 |
0 |
0.000 |
Average: |
10.3 |
0.2 |
0.739 |
0 |
0 |
0 |
0.000 |
23 |
38 |
|
D |
2 |
1 |
13846 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
2 |
1 |
13983 |
6.4 |
0.2 |
0.712 |
0 |
0 |
0 |
0.000 |
24 |
39 |
|
[NDP]E:5500 |
1 |
1 |
886 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
1 |
1 |
13846 |
1.1 |
0.0 |
0.519 |
0 |
0 |
0 |
0.000 |
40 |
|
E |
1 |
1 |
13807 |
◊ |
[NDP]D:4500 |
-x,y-1/2,-z |
2_545 |
1 |
1 |
890 |
0.3 |
-0.0 |
0.558 |
0 |
0 |
0 |
0.000 |
Average: |
0.7 |
0.0 |
0.539 |
0 |
0 |
0 |
0.000 |
25 |
41 |
|
A |
1 |
1 |
13787 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
13787 |
0.5 |
0.0 |
0.663 |
0 |
0 |
0 |
0.000 |
|