## |
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 |
118 |
38 |
16683 |
◊ |
A |
x,y,z |
1_555 |
117 |
37 |
16737 |
1102.0 |
-6.1 |
0.150 |
16 |
0 |
0 |
0.008 |
2 |
2 |
|
A |
51 |
14 |
16737 |
x |
A |
-x-1/2,y-1/2,-z |
4_445 |
48 |
15 |
16737 |
470.1 |
1.8 |
0.609 |
7 |
4 |
0 |
0.000 |
3 |
|
B |
49 |
16 |
16683 |
x |
B |
-x-1/2,y-1/2,-z-1 |
4_444 |
50 |
14 |
16683 |
468.2 |
1.9 |
0.627 |
6 |
4 |
0 |
0.000 |
Average: |
469.2 |
1.8 |
0.618 |
7 |
4 |
0 |
0.000 |
3 |
4 |
|
B |
36 |
9 |
16683 |
◊ |
B |
-x-1,y,-z-1 |
2_454 |
37 |
9 |
16683 |
261.1 |
-3.2 |
0.183 |
0 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
30 |
12 |
16683 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
27 |
11 |
16737 |
234.8 |
2.3 |
0.741 |
3 |
4 |
0 |
0.000 |
5 |
6 |
|
B |
15 |
4 |
16683 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
19 |
6 |
16737 |
146.2 |
0.1 |
0.531 |
2 |
0 |
0 |
0.000 |
7 |
|
B |
19 |
6 |
16683 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
15 |
4 |
16737 |
145.2 |
0.1 |
0.530 |
2 |
0 |
0 |
0.000 |
Average: |
145.7 |
0.1 |
0.531 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
[GOL]B:408 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
16683 |
140.1 |
-0.3 |
0.501 |
5 |
0 |
0 |
0.004 |
9 |
|
[GOL]A:409 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
16737 |
137.8 |
-0.5 |
0.476 |
5 |
0 |
0 |
0.004 |
Average: |
139.0 |
-0.4 |
0.488 |
5 |
0 |
0 |
0.004 |
7 |
10 |
|
[GOL]B:407 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
16683 |
101.1 |
0.9 |
0.655 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[PO4]B:402 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
19 |
11 |
16683 |
98.1 |
-6.0 |
0.686 |
5 |
0 |
0 |
0.012 |
9 |
12 |
|
[PO4]A:402 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
19 |
12 |
16737 |
97.9 |
-6.0 |
0.679 |
5 |
0 |
0 |
0.011 |
10 |
13 |
|
[PO4]A:407 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
16737 |
90.3 |
-5.3 |
0.713 |
1 |
0 |
0 |
0.008 |
11 |
14 |
|
[SO4]B:406 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
16683 |
85.4 |
-11.6 |
0.712 |
3 |
0 |
0 |
0.019 |
12 |
15 |
|
[PO4]A:405 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
16737 |
83.8 |
-4.8 |
0.729 |
2 |
0 |
0 |
0.008 |
13 |
16 |
|
[PO4]A:404 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
16737 |
82.1 |
-4.7 |
0.776 |
4 |
0 |
0 |
0.009 |
14 |
17 |
|
[PO4]B:404 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
16683 |
81.1 |
-4.7 |
0.785 |
4 |
0 |
0 |
0.009 |
15 |
18 |
|
[PO4]A:404 |
5 |
1 |
188 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
11 |
3 |
16737 |
76.6 |
-3.9 |
0.749 |
2 |
0 |
0 |
0.000 |
16 |
19 |
|
B |
11 |
4 |
16683 |
◊ |
[PO4]B:404 |
-x-1/2,y-1/2,-z-1 |
4_444 |
5 |
1 |
186 |
76.4 |
-3.9 |
0.744 |
3 |
0 |
0 |
0.000 |
17 |
20 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
16683 |
71.6 |
-10.0 |
0.755 |
4 |
0 |
0 |
0.017 |
18 |
21 |
|
[SO4]A:408 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
16737 |
70.7 |
-10.2 |
0.673 |
2 |
0 |
0 |
0.015 |
19 |
22 |
|
[NA]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
12 |
16683 |
68.4 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.011 |
23 |
|
[NA]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
11 |
16737 |
67.4 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
67.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.011 |
20 |
24 |
|
[GOL]A:410 |
5 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
16737 |
65.7 |
-0.3 |
0.416 |
1 |
0 |
0 |
0.000 |
21 |
25 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
16683 |
61.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.014 |
26 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
16737 |
61.0 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.014 |
Average: |
61.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.014 |
22 |
27 |
|
[PO4]A:406 |
4 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
16737 |
55.6 |
-2.3 |
0.889 |
2 |
0 |
0 |
0.004 |
23 |
28 |
|
A |
5 |
1 |
16737 |
◊ |
[GOL]A:410 |
-x-1/2,y-1/2,-z |
4_445 |
3 |
1 |
216 |
39.2 |
-0.0 |
0.509 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
[PO4]A:402 |
4 |
1 |
189 |
f |
[NA]A:401 |
x,y,z |
1_555 |
1 |
1 |
125 |
31.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.006 |
25 |
30 |
|
[PO4]B:402 |
4 |
1 |
188 |
f |
[NA]B:401 |
x,y,z |
1_555 |
1 |
1 |
125 |
30.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.007 |
26 |
31 |
|
A |
3 |
1 |
16737 |
◊ |
[PO4]A:406 |
-x-1/2,y-1/2,-z |
4_445 |
3 |
1 |
189 |
29.4 |
-2.0 |
0.433 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
[PO4]A:402 |
x,y,z |
1_555 |
4 |
1 |
189 |
18.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.004 |
28 |
33 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
[PO4]B:402 |
x,y,z |
1_555 |
4 |
1 |
188 |
17.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.004 |
29 |
34 |
|
[PO4]A:407 |
3 |
1 |
188 |
f |
[PO4]A:406 |
x,y,z |
1_555 |
1 |
1 |
189 |
14.5 |
-1.4 |
0.891 |
0 |
0 |
0 |
0.002 |
30 |
35 |
|
[GOL]B:408 |
2 |
1 |
221 |
f |
[PO4]B:402 |
x,y,z |
1_555 |
3 |
1 |
188 |
13.9 |
-0.8 |
0.643 |
0 |
0 |
0 |
0.001 |
31 |
36 |
|
[GOL]A:409 |
2 |
1 |
218 |
f |
[PO4]A:402 |
x,y,z |
1_555 |
3 |
1 |
189 |
13.6 |
-0.7 |
0.761 |
0 |
0 |
0 |
0.001 |
32 |
37 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
[NA]A:401 |
x,y,z |
1_555 |
1 |
1 |
125 |
12.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.004 |
33 |
38 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
[NA]B:401 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.003 |
34 |
39 |
|
A |
2 |
2 |
16737 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
2 |
2 |
16737 |
10.6 |
-0.3 |
0.327 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
[GOL]B:407 |
1 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
16737 |
2.1 |
0.1 |
0.625 |
0 |
0 |
0 |
0.000 |
|