## |
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 |
335 |
78 |
12767 |
◊ |
A |
x,y,z |
1_555 |
333 |
79 |
13297 |
3155.0 |
-33.3 |
0.283 |
39 |
11 |
0 |
0.279 |
2 |
|
D |
302 |
72 |
12612 |
◊ |
C |
x,y,z |
1_555 |
304 |
72 |
12480 |
2790.7 |
-33.3 |
0.247 |
29 |
3 |
0 |
0.279 |
Average: |
2972.9 |
-33.3 |
0.265 |
34 |
7 |
0 |
0.279 |
2 |
3 |
|
C |
75 |
28 |
12480 |
◊ |
A |
x,y,z |
1_555 |
75 |
24 |
13297 |
679.5 |
-12.8 |
0.072 |
3 |
0 |
0 |
0.105 |
3 |
4 |
|
B |
56 |
14 |
12767 |
◊ |
B |
-x+2,-x+y+1,-z+1/3 |
6_765 |
55 |
14 |
12767 |
519.3 |
-6.0 |
0.385 |
4 |
0 |
0 |
0.002 |
4 |
5 |
|
D |
61 |
16 |
12612 |
◊ |
C |
-y+1,x-y,z+1/3 |
2_655 |
58 |
14 |
12480 |
499.3 |
-6.0 |
0.440 |
6 |
4 |
0 |
0.000 |
5 |
6 |
|
D |
53 |
14 |
12612 |
◊ |
A |
x-y,-y+1,-z-1/3 |
5_564 |
50 |
13 |
13297 |
461.7 |
-2.6 |
0.624 |
4 |
0 |
0 |
0.000 |
6 |
7 |
|
C |
48 |
18 |
12480 |
◊ |
B |
x,y,z |
1_555 |
41 |
13 |
12767 |
460.6 |
-5.7 |
0.266 |
4 |
0 |
0 |
0.043 |
8 |
|
D |
46 |
14 |
12612 |
◊ |
A |
x,y,z |
1_555 |
48 |
15 |
13297 |
401.2 |
-8.5 |
0.103 |
2 |
0 |
0 |
0.043 |
Average: |
430.9 |
-7.1 |
0.184 |
3 |
0 |
0 |
0.043 |
7 |
9 |
|
B |
33 |
10 |
12767 |
◊ |
B |
y,x,-z |
4_555 |
32 |
10 |
12767 |
294.2 |
-4.2 |
0.372 |
0 |
0 |
0 |
0.005 |
8 |
10 |
|
B |
38 |
9 |
12767 |
◊ |
A |
-x+2,-x+y+1,-z+1/3 |
6_765 |
34 |
9 |
13297 |
288.5 |
-0.7 |
0.709 |
2 |
3 |
0 |
0.001 |
9 |
11 |
|
A |
26 |
10 |
13297 |
◊ |
A |
-x+2,-x+y+1,-z+1/3 |
6_765 |
28 |
10 |
13297 |
254.3 |
0.5 |
0.793 |
2 |
0 |
0 |
0.000 |
10 |
12 |
|
[GOL]D:505 |
6 |
1 |
223 |
f |
D |
x,y,z |
1_555 |
26 |
10 |
12612 |
143.5 |
-1.5 |
0.490 |
0 |
0 |
0 |
0.009 |
11 |
13 |
|
C |
21 |
7 |
12480 |
◊ |
C |
-x+2,-x+y+1,-z-2/3 |
6_764 |
22 |
7 |
12480 |
136.5 |
1.6 |
0.864 |
0 |
2 |
0 |
0.000 |
12 |
14 |
|
B |
16 |
4 |
12767 |
◊ |
C |
-y+1,x-y,z+1/3 |
2_655 |
14 |
4 |
12480 |
134.2 |
-1.6 |
0.418 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
D |
18 |
8 |
12612 |
x |
D |
-y+1,x-y,z+1/3 |
2_655 |
12 |
3 |
12612 |
133.1 |
-0.0 |
0.734 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
D |
18 |
6 |
12612 |
◊ |
C |
x-y,-y+1,-z-1/3 |
5_564 |
13 |
4 |
12480 |
131.0 |
-0.8 |
0.427 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
[GOL]A:501 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
13297 |
118.4 |
-0.8 |
0.512 |
1 |
0 |
0 |
0.009 |
16 |
18 |
|
D |
12 |
7 |
12612 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
12767 |
118.1 |
-0.3 |
0.659 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
D |
17 |
4 |
12612 |
◊ |
B |
y,x,-z |
4_555 |
15 |
5 |
12767 |
115.1 |
0.4 |
0.715 |
2 |
3 |
0 |
0.002 |
18 |
20 |
|
[GOL]B:502 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
12767 |
110.8 |
-0.3 |
0.625 |
5 |
0 |
0 |
0.013 |
19 |
21 |
|
[SO4]C:2404 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
12480 |
107.0 |
-20.8 |
0.727 |
8 |
0 |
0 |
0.181 |
20 |
22 |
|
[SO4]A:404 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
13297 |
105.0 |
-20.6 |
0.725 |
10 |
0 |
0 |
0.256 |
23 |
|
[SO4]B:1404 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
12767 |
104.7 |
-20.4 |
0.733 |
8 |
0 |
0 |
0.256 |
Average: |
104.8 |
-20.5 |
0.729 |
9 |
0 |
0 |
0.256 |
21 |
24 |
|
[SO4]D:3404 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
12612 |
104.4 |
-20.3 |
0.721 |
10 |
0 |
0 |
0.148 |
22 |
25 |
|
[GOL]B:506 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
16 |
4 |
13297 |
99.5 |
-1.6 |
0.385 |
0 |
0 |
0 |
0.012 |
23 |
26 |
|
[SO4]C:2405 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
10 |
12480 |
98.0 |
-16.0 |
0.786 |
5 |
0 |
0 |
0.135 |
24 |
27 |
|
[SO4]A:406 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
13297 |
97.8 |
-15.8 |
0.886 |
5 |
0 |
0 |
0.134 |
25 |
28 |
|
[SO4]D:3406 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
16 |
10 |
12612 |
97.3 |
-16.0 |
0.793 |
5 |
0 |
0 |
0.109 |
26 |
29 |
|
[GOL]A:504 |
6 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
12767 |
95.3 |
-0.1 |
0.644 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[GOL]A:504 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
13297 |
95.2 |
-0.9 |
0.500 |
1 |
0 |
0 |
0.010 |
28 |
31 |
|
[SO4]B:1406 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
12767 |
95.1 |
-16.4 |
0.777 |
7 |
0 |
0 |
0.102 |
29 |
32 |
|
[GOL]B:506 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
17 |
6 |
12767 |
92.5 |
-0.3 |
0.606 |
2 |
0 |
0 |
0.006 |
30 |
33 |
|
[SO4]B:1405 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
12767 |
77.5 |
-11.2 |
0.720 |
2 |
0 |
0 |
0.063 |
31 |
34 |
|
C |
9 |
3 |
12480 |
x |
C |
-y+1,x-y,z+1/3 |
2_655 |
10 |
2 |
12480 |
68.8 |
-0.9 |
0.466 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[SO4]D:3405 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
12612 |
66.6 |
-9.7 |
0.667 |
3 |
0 |
0 |
0.066 |
33 |
36 |
|
[SO4]A:405 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
13297 |
63.9 |
-8.7 |
0.733 |
2 |
0 |
0 |
0.071 |
34 |
37 |
|
[GOL]B:503 |
5 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
9 |
1 |
12767 |
63.2 |
-0.9 |
0.399 |
0 |
0 |
0 |
0.005 |
35 |
38 |
|
B |
7 |
4 |
12767 |
◊ |
A |
y,x,-z |
4_555 |
8 |
5 |
13297 |
61.8 |
0.0 |
0.653 |
0 |
0 |
0 |
0.000 |
36 |
39 |
|
[MN]D:3402 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
12612 |
59.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.060 |
40 |
|
[MN]C:2402 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
12480 |
59.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.060 |
41 |
|
[MN]A:402 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
13297 |
59.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.060 |
42 |
|
[MN]B:1402 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
12767 |
59.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
59.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.060 |
37 |
43 |
|
[GOL]B:503 |
6 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
8 |
1 |
12612 |
59.8 |
-0.9 |
0.396 |
0 |
0 |
0 |
0.002 |
38 |
44 |
|
[GOL]B:502 |
3 |
1 |
219 |
◊ |
B |
y,x,-z |
4_555 |
4 |
1 |
12767 |
39.0 |
-0.2 |
0.450 |
0 |
0 |
0 |
0.000 |
39 |
45 |
|
[SO4]B:1406 |
3 |
1 |
186 |
f |
[MN]B:1402 |
x,y,z |
1_555 |
1 |
1 |
123 |
36.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.064 |
46 |
|
[SO4]D:3406 |
3 |
1 |
186 |
f |
[MN]D:3402 |
x,y,z |
1_555 |
1 |
1 |
123 |
36.3 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.064 |
47 |
|
[SO4]A:406 |
2 |
1 |
187 |
f |
[MN]A:402 |
x,y,z |
1_555 |
1 |
1 |
123 |
36.0 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.064 |
Average: |
36.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.064 |
40 |
48 |
|
[SO4]C:2405 |
3 |
1 |
185 |
f |
[MN]C:2402 |
x,y,z |
1_555 |
1 |
1 |
123 |
35.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.047 |
41 |
49 |
|
D |
3 |
1 |
12612 |
◊ |
[GOL]A:501 |
x-y,-y+1,-z-1/3 |
5_564 |
2 |
1 |
219 |
9.7 |
0.1 |
0.630 |
0 |
0 |
0 |
0.000 |
42 |
50 |
|
[SO4]D:3405 |
1 |
1 |
185 |
f |
[SO4]D:3404 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.3 |
-1.5 |
0.800 |
0 |
0 |
0 |
0.009 |
43 |
51 |
|
[SO4]B:1405 |
1 |
1 |
186 |
f |
[SO4]B:1404 |
x,y,z |
1_555 |
1 |
1 |
186 |
4.7 |
-1.1 |
0.800 |
0 |
0 |
0 |
0.006 |
44 |
52 |
|
[SO4]A:405 |
1 |
1 |
184 |
f |
[SO4]A:404 |
x,y,z |
1_555 |
1 |
1 |
184 |
2.1 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.004 |
45 |
53 |
|
[SO4]B:1404 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13297 |
1.1 |
-0.1 |
0.736 |
0 |
0 |
0 |
0.000 |
46 |
54 |
|
[SO4]D:3404 |
1 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
12480 |
0.8 |
-0.1 |
0.767 |
0 |
0 |
0 |
0.000 |
47 |
55 |
|
[SO4]C:2404 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
12612 |
0.4 |
-0.1 |
0.782 |
0 |
0 |
0 |
0.000 |
|