## |
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 |
104 |
30 |
14530 |
◊ |
C |
-y,x-y,z-1/3 |
2_554 |
104 |
32 |
14570 |
1167.0 |
-18.1 |
0.008 |
6 |
2 |
0 |
0.260 |
2 |
|
D |
105 |
33 |
14592 |
◊ |
B |
x,y,z |
1_555 |
109 |
31 |
14516 |
1154.4 |
-18.4 |
0.007 |
6 |
1 |
0 |
0.260 |
Average: |
1160.7 |
-18.2 |
0.008 |
6 |
2 |
0 |
0.260 |
2 |
3 |
|
A |
82 |
24 |
14530 |
◊ |
B |
x-1,y,z |
1_455 |
71 |
13 |
14516 |
746.2 |
-4.0 |
0.420 |
12 |
8 |
0 |
0.000 |
4 |
|
B |
80 |
24 |
14516 |
◊ |
A |
x,y,z |
1_555 |
72 |
13 |
14530 |
739.4 |
-3.9 |
0.428 |
12 |
8 |
0 |
0.000 |
Average: |
742.8 |
-4.0 |
0.424 |
12 |
8 |
0 |
0.000 |
3 |
5 |
|
[NAD]C:343 |
43 |
1 |
822 |
f |
C |
x,y,z |
1_555 |
78 |
32 |
14570 |
551.6 |
-6.2 |
0.532 |
13 |
0 |
0 |
0.308 |
6 |
|
[NAD]D:343 |
43 |
1 |
821 |
f |
D |
x,y,z |
1_555 |
82 |
32 |
14592 |
551.5 |
-6.2 |
0.546 |
15 |
0 |
0 |
0.308 |
7 |
|
[NAD]A:343 |
43 |
1 |
825 |
f |
A |
x,y,z |
1_555 |
78 |
33 |
14530 |
549.1 |
-6.6 |
0.533 |
13 |
0 |
0 |
0.308 |
8 |
|
[NAD]B:343 |
42 |
1 |
824 |
f |
B |
x,y,z |
1_555 |
75 |
32 |
14516 |
543.9 |
-6.6 |
0.533 |
13 |
0 |
0 |
0.308 |
Average: |
549.0 |
-6.4 |
0.536 |
14 |
0 |
0 |
0.308 |
4 |
9 |
|
[UD2]C:344 |
38 |
1 |
739 |
f |
C |
x,y,z |
1_555 |
70 |
25 |
14570 |
528.8 |
-3.7 |
0.634 |
17 |
0 |
0 |
0.283 |
10 |
|
[UD2]A:344 |
36 |
1 |
743 |
f |
A |
x,y,z |
1_555 |
72 |
27 |
14530 |
528.1 |
-3.2 |
0.639 |
20 |
0 |
0 |
0.283 |
11 |
|
[UD2]D:344 |
36 |
1 |
739 |
f |
D |
x,y,z |
1_555 |
71 |
25 |
14592 |
526.9 |
-3.7 |
0.624 |
15 |
0 |
0 |
0.283 |
12 |
|
[UD2]B:344 |
37 |
1 |
741 |
f |
B |
x,y,z |
1_555 |
72 |
27 |
14516 |
523.8 |
-2.9 |
0.647 |
18 |
0 |
0 |
0.283 |
Average: |
526.9 |
-3.4 |
0.636 |
18 |
0 |
0 |
0.283 |
5 |
13 |
|
D |
54 |
20 |
14592 |
◊ |
C |
x,y,z |
1_555 |
54 |
14 |
14570 |
509.6 |
-3.8 |
0.305 |
4 |
0 |
0 |
0.000 |
14 |
|
C |
56 |
21 |
14570 |
◊ |
D |
x,y-1,z |
1_545 |
54 |
14 |
14592 |
502.1 |
-3.6 |
0.317 |
4 |
0 |
0 |
0.000 |
Average: |
505.9 |
-3.7 |
0.311 |
4 |
0 |
0 |
0.000 |
6 |
15 |
|
C |
21 |
6 |
14570 |
◊ |
D |
x-1,y-1,z |
1_445 |
20 |
6 |
14592 |
191.0 |
-1.3 |
0.444 |
0 |
0 |
0 |
0.000 |
7 |
16 |
|
A |
11 |
5 |
14530 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
8 |
3 |
14592 |
92.9 |
0.2 |
0.510 |
1 |
2 |
0 |
0.000 |
17 |
|
C |
7 |
3 |
14570 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
14516 |
90.1 |
0.2 |
0.478 |
1 |
2 |
0 |
0.000 |
Average: |
91.5 |
0.2 |
0.494 |
1 |
2 |
0 |
0.000 |
8 |
18 |
|
[SO4]B:345 |
5 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
14516 |
83.2 |
-9.5 |
0.897 |
4 |
0 |
0 |
0.000 |
9 |
19 |
|
[SO4]A:345 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
14530 |
83.0 |
-9.4 |
0.912 |
5 |
0 |
0 |
0.000 |
10 |
20 |
|
[SO4]A:345 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
14516 |
73.0 |
-10.0 |
0.866 |
4 |
0 |
0 |
0.145 |
11 |
21 |
|
A |
13 |
5 |
14530 |
f |
[SO4]B:345 |
x-1,y,z |
1_455 |
5 |
1 |
183 |
72.5 |
-9.8 |
0.871 |
4 |
0 |
0 |
0.141 |
12 |
22 |
|
[UD2]A:344 |
6 |
1 |
743 |
f |
[NAD]A:343 |
x,y,z |
1_555 |
10 |
1 |
825 |
67.8 |
-1.0 |
0.590 |
0 |
0 |
0 |
0.027 |
23 |
|
[UD2]C:344 |
6 |
1 |
739 |
f |
[NAD]C:343 |
x,y,z |
1_555 |
10 |
1 |
822 |
66.5 |
-1.1 |
0.580 |
0 |
0 |
0 |
0.027 |
24 |
|
[UD2]B:344 |
6 |
1 |
741 |
f |
[NAD]B:343 |
x,y,z |
1_555 |
10 |
1 |
824 |
65.9 |
-1.1 |
0.581 |
0 |
0 |
0 |
0.027 |
25 |
|
[UD2]D:344 |
6 |
1 |
739 |
f |
[NAD]D:343 |
x,y,z |
1_555 |
9 |
1 |
821 |
63.9 |
-1.0 |
0.572 |
0 |
0 |
0 |
0.027 |
Average: |
66.0 |
-1.0 |
0.581 |
0 |
0 |
0 |
0.027 |
13 |
26 |
|
[NAD]A:343 |
2 |
1 |
825 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
14516 |
4.9 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
27 |
|
[NAD]B:343 |
2 |
1 |
824 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14530 |
4.0 |
0.2 |
0.700 |
0 |
0 |
0 |
0.000 |
Average: |
4.5 |
0.2 |
0.712 |
0 |
0 |
0 |
0.000 |
14 |
28 |
|
[NAD]C:343 |
2 |
1 |
822 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
14592 |
2.6 |
-0.0 |
0.475 |
0 |
0 |
0 |
0.000 |
29 |
|
[NAD]D:343 |
1 |
1 |
821 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
14570 |
0.4 |
-0.0 |
0.599 |
0 |
0 |
0 |
0.000 |
Average: |
1.5 |
-0.0 |
0.537 |
0 |
0 |
0 |
0.000 |
15 |
30 |
|
C |
1 |
1 |
14570 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
14530 |
0.3 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
|