| ## |
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 |
60 |
23 |
17259 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
61 |
23 |
17259 |
566.4 |
-5.3 |
0.322 |
1 |
0 |
0 |
0.000 |
| 2 |
2 |
|
A |
41 |
15 |
17259 |
x |
A |
-y+1/2,x+1/2,z-1/4 |
3_554 |
40 |
14 |
17259 |
382.1 |
-4.0 |
0.296 |
3 |
1 |
0 |
0.000 |
| 3 |
3 |
|
B |
40 |
16 |
17044 |
x |
B |
-y+1/2,x-1/2,z-1/4 |
3_544 |
39 |
14 |
17044 |
380.2 |
-4.0 |
0.302 |
3 |
3 |
0 |
0.000 |
| 4 |
4 |
|
B |
32 |
8 |
17044 |
◊ |
A |
x,y,z |
1_555 |
36 |
13 |
17259 |
326.6 |
-3.7 |
0.246 |
0 |
1 |
0 |
0.000 |
| 5 |
5 |
|
B |
18 |
6 |
17044 |
◊ |
A |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
21 |
6 |
17259 |
192.3 |
-4.1 |
0.073 |
1 |
0 |
1 |
0.000 |
| 6 |
6 |
|
A |
18 |
7 |
17259 |
◊ |
B |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
22 |
7 |
17044 |
179.1 |
-0.5 |
0.604 |
0 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[GOL]B:502 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
17044 |
137.9 |
-0.2 |
0.532 |
1 |
0 |
0 |
0.002 |
8 |
|
[GOL]A:503 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
17259 |
136.4 |
-0.3 |
0.529 |
1 |
0 |
0 |
0.002 |
| Average: |
137.1 |
-0.2 |
0.530 |
1 |
0 |
0 |
0.002 |
| 8 |
9 |
|
[GOL]A:505 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
17259 |
134.6 |
0.5 |
0.582 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[GOL]A:501 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
17259 |
121.7 |
-2.0 |
0.213 |
1 |
0 |
0 |
0.007 |
| 10 |
11 |
|
[GOL]B:503 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
17044 |
121.3 |
-2.1 |
0.212 |
0 |
0 |
0 |
0.006 |
| 11 |
12 |
|
[GOL]B:504 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
17044 |
119.0 |
-1.5 |
0.413 |
1 |
0 |
0 |
0.005 |
| 12 |
13 |
|
[GOL]B:501 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
24 |
7 |
17044 |
118.4 |
-0.2 |
0.515 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[GOL]A:502 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
17259 |
114.1 |
-0.7 |
0.465 |
2 |
0 |
0 |
0.005 |
| 14 |
15 |
|
[GOL]B:505 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
17044 |
110.2 |
0.6 |
0.730 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[GOL]A:504 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
17259 |
91.7 |
-0.8 |
0.471 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[CL]A:506 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
17259 |
75.7 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.032 |
18 |
|
[CL]B:506 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
17044 |
75.4 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
75.6 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.032 |
| 17 |
19 |
|
[FE]B:508 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
17044 |
74.1 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.038 |
20 |
|
[FE]A:508 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
17259 |
72.8 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.038 |
| Average: |
73.4 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.038 |
| 18 |
21 |
|
[GOL]A:504 |
6 |
1 |
221 |
f |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
8 |
3 |
17259 |
72.7 |
0.3 |
0.662 |
3 |
0 |
0 |
0.003 |
| 19 |
22 |
|
[GOL]A:503 |
4 |
1 |
219 |
f |
[GOL]A:502 |
x,y,z |
1_555 |
4 |
1 |
216 |
44.1 |
0.8 |
0.646 |
2 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[GOL]B:502 |
4 |
1 |
217 |
f |
[GOL]B:501 |
x,y,z |
1_555 |
3 |
1 |
220 |
41.7 |
0.6 |
0.642 |
1 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[MG]B:507 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
17044 |
38.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.012 |
| 22 |
25 |
|
[MG]B:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
17259 |
35.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[GOL]A:504 |
3 |
1 |
221 |
◊ |
[GOL]A:504 |
-y+1,-x+1,-z+1/2 |
8_665 |
3 |
1 |
221 |
31.3 |
-1.0 |
0.292 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
B |
3 |
2 |
17044 |
◊ |
B |
y,x,-z |
7_555 |
3 |
2 |
17044 |
17.3 |
-0.6 |
0.291 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[MG]A:507 |
1 |
1 |
98 |
f |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
3 |
3 |
17259 |
16.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.005 |
| 26 |
29 |
|
[FE]B:508 |
1 |
1 |
137 |
f |
[CL]B:506 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.008 |
| 27 |
30 |
|
[FE]A:508 |
1 |
1 |
137 |
f |
[CL]A:506 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.009 |
| 28 |
31 |
|
[MG]B:507 |
1 |
1 |
98 |
f |
[GOL]B:504 |
x,y,z |
1_555 |
2 |
1 |
216 |
11.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.003 |
| 29 |
32 |
|
[MG]A:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17259 |
6.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[GOL]B:504 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17259 |
2.6 |
0.1 |
0.614 |
0 |
0 |
0 |
0.000 |
|