| ## |
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 |
122 |
27 |
19704 |
◊ |
A |
x,y,z |
1_555 |
120 |
28 |
19541 |
1139.7 |
-34.0 |
0.000 |
0 |
0 |
0 |
0.267 |
| 2 |
2 |
|
[FAD]A:611 |
52 |
1 |
999 |
f |
A |
x,y,z |
1_555 |
104 |
44 |
19541 |
760.1 |
-7.2 |
0.588 |
14 |
0 |
0 |
0.229 |
3 |
|
[FAD]B:606 |
52 |
1 |
1002 |
f |
B |
x,y,z |
1_555 |
106 |
47 |
19704 |
750.7 |
-8.7 |
0.512 |
16 |
0 |
0 |
0.229 |
| Average: |
755.4 |
-7.9 |
0.550 |
15 |
0 |
0 |
0.229 |
| 3 |
4 |
|
[EKV]A:610 |
31 |
1 |
804 |
f |
A |
x,y,z |
1_555 |
91 |
34 |
19541 |
569.6 |
-11.7 |
0.318 |
0 |
0 |
0 |
0.187 |
5 |
|
[EKV]B:605 |
32 |
1 |
806 |
f |
B |
x,y,z |
1_555 |
89 |
34 |
19704 |
568.5 |
-12.0 |
0.302 |
0 |
0 |
0 |
0.187 |
| Average: |
569.0 |
-11.9 |
0.310 |
0 |
0 |
0 |
0.187 |
| 4 |
6 |
|
A |
52 |
15 |
19541 |
◊ |
A |
-x,-x+y,-z+2/3 |
6_555 |
52 |
15 |
19541 |
508.1 |
-1.7 |
0.619 |
8 |
0 |
0 |
0.000 |
7 |
|
B |
49 |
15 |
19704 |
◊ |
B |
-x,-x+y,-z+2/3 |
6_555 |
49 |
15 |
19704 |
496.1 |
-2.8 |
0.492 |
8 |
0 |
0 |
0.000 |
| Average: |
502.1 |
-2.3 |
0.556 |
8 |
0 |
0 |
0.000 |
| 5 |
8 |
|
B |
46 |
14 |
19704 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
47 |
14 |
19541 |
402.7 |
-3.2 |
0.392 |
3 |
2 |
0 |
0.000 |
| 6 |
9 |
|
B |
39 |
8 |
19704 |
◊ |
B |
y,x,-z+1 |
4_556 |
39 |
8 |
19704 |
374.6 |
1.8 |
0.840 |
2 |
10 |
0 |
0.000 |
| 7 |
10 |
|
[CPS]B:603 |
19 |
1 |
620 |
◊ |
B |
x,y,z |
1_555 |
24 |
6 |
19704 |
211.5 |
0.2 |
0.176 |
0 |
0 |
0 |
0.000 |
11 |
|
[CPS]A:608 |
18 |
1 |
589 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
19541 |
204.6 |
0.5 |
0.178 |
0 |
0 |
0 |
0.000 |
| Average: |
208.1 |
0.4 |
0.177 |
0 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[CPS]A:605 |
15 |
1 |
642 |
f |
B |
x,y,z |
1_555 |
27 |
7 |
19704 |
192.6 |
-0.8 |
0.247 |
0 |
0 |
0 |
0.011 |
13 |
|
[CPS]A:606 |
15 |
1 |
618 |
f |
A |
x,y,z |
1_555 |
29 |
7 |
19541 |
191.3 |
-0.7 |
0.252 |
0 |
0 |
0 |
0.011 |
| Average: |
192.0 |
-0.7 |
0.249 |
0 |
0 |
0 |
0.011 |
| 9 |
14 |
|
[CPS]A:609 |
13 |
1 |
508 |
◊ |
A |
x,y,z |
1_555 |
26 |
9 |
19541 |
183.9 |
0.8 |
0.493 |
0 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[CPS]A:605 |
17 |
1 |
642 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
19541 |
167.2 |
1.0 |
0.454 |
0 |
0 |
0 |
0.000 |
16 |
|
[CPS]A:606 |
17 |
1 |
618 |
◊ |
B |
x,y,z |
1_555 |
22 |
9 |
19704 |
164.3 |
1.3 |
0.426 |
0 |
0 |
0 |
0.000 |
| Average: |
165.7 |
1.1 |
0.440 |
0 |
0 |
0 |
0.000 |
| 11 |
17 |
|
[CPS]B:604 |
11 |
1 |
536 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
19541 |
136.3 |
1.6 |
0.351 |
0 |
0 |
0 |
0.000 |
18 |
|
[CPS]A:607 |
12 |
1 |
532 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
19704 |
127.9 |
0.7 |
0.258 |
0 |
0 |
0 |
0.000 |
| Average: |
132.1 |
1.2 |
0.305 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[GOL]B:601 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
19704 |
134.7 |
0.0 |
0.639 |
1 |
0 |
0 |
0.003 |
| 13 |
20 |
|
[CPS]B:604 |
11 |
1 |
536 |
f |
B |
x,y,z |
1_555 |
19 |
4 |
19704 |
130.1 |
-0.3 |
0.232 |
0 |
0 |
0 |
0.007 |
21 |
|
[CPS]A:607 |
11 |
1 |
532 |
f |
A |
x,y,z |
1_555 |
17 |
3 |
19541 |
125.6 |
-0.5 |
0.216 |
0 |
0 |
0 |
0.007 |
| Average: |
127.8 |
-0.4 |
0.224 |
0 |
0 |
0 |
0.007 |
| 14 |
22 |
|
[GOL]A:601 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
19541 |
124.9 |
-0.2 |
0.561 |
2 |
0 |
0 |
0.009 |
| 15 |
23 |
|
B |
20 |
4 |
19704 |
f |
[CPS]A:609 |
-y+1,x-y+1,z-1/3 |
2_664 |
12 |
1 |
508 |
113.4 |
-1.2 |
0.263 |
0 |
0 |
0 |
0.010 |
| 16 |
24 |
|
[SO4]B:602 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
19704 |
106.8 |
-16.4 |
0.791 |
3 |
0 |
0 |
0.139 |
| 17 |
25 |
|
[SO4]A:604 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
11 |
19541 |
104.5 |
-15.6 |
0.825 |
5 |
0 |
0 |
0.140 |
| 18 |
26 |
|
[GOL]A:603 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
19541 |
90.0 |
1.1 |
0.750 |
1 |
0 |
0 |
0.000 |
| 19 |
27 |
|
[GOL]A:602 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
19541 |
89.6 |
0.4 |
0.671 |
4 |
0 |
0 |
0.010 |
| 20 |
28 |
|
[CPS]A:608 |
10 |
1 |
589 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
19704 |
83.7 |
-1.7 |
0.129 |
0 |
0 |
0 |
0.027 |
29 |
|
[CPS]B:603 |
10 |
1 |
620 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
19541 |
83.6 |
-1.7 |
0.181 |
0 |
0 |
0 |
0.027 |
| Average: |
83.7 |
-1.7 |
0.155 |
0 |
0 |
0 |
0.027 |
| 21 |
30 |
|
[CPS]A:608 |
11 |
1 |
589 |
◊ |
[CPS]A:607 |
x,y,z |
1_555 |
10 |
1 |
532 |
75.7 |
0.2 |
0.140 |
0 |
0 |
0 |
0.000 |
31 |
|
[CPS]B:604 |
9 |
1 |
536 |
◊ |
[CPS]B:603 |
x,y,z |
1_555 |
11 |
1 |
620 |
72.7 |
0.1 |
0.167 |
0 |
0 |
0 |
0.000 |
| Average: |
74.2 |
0.1 |
0.153 |
0 |
0 |
0 |
0.000 |
| 22 |
32 |
|
A |
8 |
2 |
19541 |
◊ |
[CPS]A:609 |
-y+1,x-y+1,z-1/3 |
2_664 |
5 |
1 |
508 |
49.0 |
-0.2 |
0.349 |
0 |
0 |
0 |
0.002 |
| 23 |
33 |
|
A |
4 |
1 |
19541 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
5 |
2 |
19541 |
43.2 |
-0.7 |
0.347 |
0 |
0 |
0 |
0.000 |
| 24 |
34 |
|
[CPS]A:606 |
6 |
1 |
618 |
◊ |
[CPS]A:605 |
x,y,z |
1_555 |
6 |
1 |
642 |
43.2 |
-0.7 |
0.220 |
0 |
0 |
0 |
0.006 |
| 25 |
35 |
|
[CPS]B:603 |
4 |
1 |
620 |
◊ |
[CPS]A:608 |
x,y,z |
1_555 |
4 |
1 |
589 |
38.1 |
1.1 |
0.478 |
0 |
0 |
0 |
0.000 |
| 26 |
36 |
|
[FAD]A:611 |
4 |
1 |
999 |
f |
[EKV]A:610 |
x,y,z |
1_555 |
3 |
1 |
804 |
31.5 |
-0.6 |
0.618 |
0 |
0 |
0 |
0.009 |
37 |
|
[FAD]B:606 |
5 |
1 |
1002 |
f |
[EKV]B:605 |
x,y,z |
1_555 |
3 |
1 |
806 |
30.2 |
-0.6 |
0.635 |
0 |
0 |
0 |
0.009 |
| Average: |
30.8 |
-0.6 |
0.627 |
0 |
0 |
0 |
0.009 |
| 27 |
38 |
|
B |
3 |
2 |
19704 |
◊ |
A |
y-1,x,-z+1 |
4_456 |
5 |
3 |
19541 |
23.0 |
0.3 |
0.766 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
[GOL]A:602 |
3 |
1 |
215 |
◊ |
[GOL]A:602 |
-x,-x+y,-z+2/3 |
6_555 |
2 |
1 |
215 |
10.1 |
-0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
| 29 |
40 |
|
[GOL]B:601 |
2 |
1 |
217 |
◊ |
B |
-x,-x+y,-z+2/3 |
6_555 |
1 |
1 |
19704 |
6.4 |
-0.1 |
0.426 |
0 |
0 |
0 |
0.000 |
|