## |
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 |
239 |
68 |
14310 |
◊ |
A |
x,y,z |
1_555 |
238 |
67 |
14220 |
2499.4 |
-40.0 |
0.002 |
23 |
8 |
0 |
0.356 |
2 |
2 |
|
D |
64 |
19 |
4779 |
◊ |
B |
x,y,z |
1_555 |
53 |
13 |
14310 |
594.7 |
-10.9 |
0.263 |
4 |
3 |
0 |
0.148 |
3 |
3 |
|
C |
34 |
12 |
2069 |
◊ |
A |
x,y,z |
1_555 |
46 |
11 |
14220 |
415.5 |
-9.0 |
0.387 |
1 |
0 |
0 |
0.147 |
4 |
4 |
|
[G5A]B:402 |
27 |
1 |
559 |
f |
B |
x,y,z |
1_555 |
67 |
25 |
14310 |
378.6 |
4.0 |
0.587 |
10 |
0 |
0 |
0.018 |
5 |
|
[G5A]A:1001 |
27 |
1 |
563 |
f |
A |
x,y,z |
1_555 |
60 |
25 |
14220 |
373.1 |
3.7 |
0.581 |
11 |
0 |
0 |
0.018 |
Average: |
375.9 |
3.8 |
0.584 |
11 |
0 |
0 |
0.018 |
5 |
6 |
|
[PNS]D:1000 |
19 |
1 |
535 |
◊ |
B |
x,y,z |
1_555 |
51 |
22 |
14310 |
345.1 |
-9.6 |
0.626 |
5 |
0 |
0 |
0.167 |
7 |
|
[PNS]C:1000 |
18 |
1 |
534 |
◊ |
A |
x,y,z |
1_555 |
56 |
22 |
14220 |
332.7 |
-9.9 |
0.518 |
2 |
0 |
0 |
0.167 |
Average: |
338.9 |
-9.7 |
0.572 |
4 |
0 |
0 |
0.167 |
6 |
8 |
|
B |
33 |
8 |
14310 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
38 |
15 |
14220 |
328.3 |
-3.7 |
0.291 |
4 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
27 |
11 |
14220 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
40 |
10 |
14310 |
317.2 |
-0.7 |
0.652 |
4 |
7 |
0 |
0.000 |
8 |
10 |
|
B |
23 |
7 |
14310 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
23 |
7 |
14220 |
200.5 |
-2.7 |
0.325 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
[SO4]B:404 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14310 |
85.7 |
-9.6 |
0.956 |
2 |
0 |
0 |
0.118 |
10 |
12 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
14310 |
79.2 |
-10.3 |
0.842 |
1 |
0 |
0 |
0.121 |
11 |
13 |
|
B |
10 |
6 |
14310 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
3 |
4779 |
77.4 |
-1.5 |
0.346 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
A |
10 |
5 |
14220 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
9 |
3 |
14220 |
76.8 |
-0.2 |
0.609 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
[PNS]C:1000 |
6 |
1 |
534 |
cf |
C |
x,y,z |
1_555 |
9 |
3 |
2069 |
71.5 |
-1.9 |
0.834 |
1 |
0 |
0 |
0.100 |
14 |
16 |
|
[PNS]D:1000 |
6 |
1 |
535 |
cf |
D |
x,y,z |
1_555 |
7 |
3 |
4779 |
65.0 |
-1.3 |
0.794 |
1 |
0 |
0 |
0.100 |
15 |
17 |
|
[PNS]C:1000 |
3 |
1 |
534 |
◊ |
[G5A]A:1001 |
x,y,z |
1_555 |
7 |
1 |
563 |
50.0 |
-1.3 |
0.388 |
0 |
0 |
0 |
0.019 |
18 |
|
[PNS]D:1000 |
3 |
1 |
535 |
◊ |
[G5A]B:402 |
x,y,z |
1_555 |
7 |
1 |
559 |
48.2 |
-1.1 |
0.396 |
0 |
0 |
0 |
0.019 |
Average: |
49.1 |
-1.2 |
0.392 |
0 |
0 |
0 |
0.019 |
16 |
19 |
|
A |
4 |
3 |
14220 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
2069 |
41.8 |
-0.4 |
0.370 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[SO4]B:403 |
4 |
1 |
185 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
5 |
2 |
14220 |
35.9 |
-5.0 |
0.582 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
14310 |
31.8 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.367 |
22 |
|
[ZN]A:1000 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
14220 |
31.5 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.367 |
Average: |
31.6 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.367 |
19 |
23 |
|
D |
3 |
2 |
4779 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
14310 |
30.8 |
-0.7 |
0.326 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[G5A]A:1001 |
2 |
1 |
563 |
f |
[ZN]A:1000 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.9 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.167 |
25 |
|
[G5A]B:402 |
2 |
1 |
559 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.3 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.167 |
Average: |
27.6 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.167 |
21 |
26 |
|
[PNS]C:1000 |
2 |
1 |
534 |
◊ |
[ZN]A:1000 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.078 |
27 |
|
[PNS]D:1000 |
2 |
1 |
535 |
◊ |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.078 |
Average: |
13.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.078 |
22 |
28 |
|
[SO4]B:404 |
1 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14220 |
7.6 |
-1.0 |
0.458 |
0 |
0 |
0 |
0.007 |
|