## |
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 |
|
F |
176 |
50 |
12795 |
◊ |
E |
x,y,z |
1_555 |
185 |
52 |
12848 |
1717.7 |
-29.1 |
0.017 |
13 |
10 |
0 |
0.327 |
2 |
|
D |
178 |
51 |
12797 |
◊ |
C |
x,y,z |
1_555 |
179 |
51 |
12762 |
1700.1 |
-29.4 |
0.014 |
14 |
10 |
0 |
0.327 |
3 |
|
B |
176 |
50 |
12807 |
◊ |
A |
x,y,z |
1_555 |
181 |
51 |
12782 |
1685.2 |
-28.2 |
0.022 |
16 |
10 |
0 |
0.327 |
4 |
|
H |
178 |
49 |
12824 |
◊ |
G |
x,y,z |
1_555 |
170 |
49 |
12788 |
1675.1 |
-27.7 |
0.021 |
14 |
10 |
0 |
0.327 |
Average: |
1694.5 |
-28.6 |
0.019 |
14 |
10 |
0 |
0.327 |
2 |
5 |
|
H |
81 |
21 |
12824 |
◊ |
D |
x,y,z |
1_555 |
82 |
24 |
12797 |
734.0 |
-2.9 |
0.712 |
7 |
0 |
0 |
0.000 |
3 |
6 |
|
C |
61 |
19 |
12762 |
◊ |
B |
y,x,-z |
7_555 |
65 |
18 |
12807 |
646.9 |
-6.5 |
0.344 |
7 |
2 |
0 |
0.000 |
4 |
7 |
|
G |
62 |
19 |
12788 |
◊ |
E |
-y+1/2,x-1/2,z-1/4 |
3_544 |
55 |
18 |
12848 |
636.1 |
-6.5 |
0.305 |
4 |
2 |
0 |
0.000 |
8 |
|
F |
61 |
19 |
12795 |
◊ |
A |
x,y,z |
1_555 |
59 |
19 |
12782 |
618.3 |
-5.9 |
0.368 |
6 |
2 |
0 |
0.000 |
Average: |
627.2 |
-6.2 |
0.336 |
5 |
2 |
0 |
0.000 |
5 |
9 |
|
B |
74 |
23 |
12807 |
◊ |
C |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
70 |
21 |
12762 |
627.6 |
-4.6 |
0.557 |
10 |
0 |
0 |
0.000 |
6 |
10 |
|
[AA5]E:401 |
24 |
1 |
568 |
f |
E |
x,y,z |
1_555 |
61 |
29 |
12848 |
405.2 |
-5.5 |
0.606 |
15 |
0 |
0 |
0.195 |
11 |
|
[AA5]D:401 |
24 |
1 |
567 |
f |
D |
x,y,z |
1_555 |
61 |
28 |
12797 |
402.6 |
-5.4 |
0.600 |
11 |
0 |
0 |
0.195 |
12 |
|
[AA5]A:401 |
24 |
1 |
558 |
f |
A |
x,y,z |
1_555 |
59 |
29 |
12782 |
400.2 |
-5.4 |
0.610 |
15 |
0 |
0 |
0.195 |
13 |
|
[AA5]C:401 |
24 |
1 |
560 |
f |
C |
x,y,z |
1_555 |
57 |
26 |
12762 |
397.6 |
-5.3 |
0.610 |
12 |
0 |
0 |
0.195 |
14 |
|
[AA5]F:401 |
24 |
1 |
561 |
f |
F |
x,y,z |
1_555 |
60 |
29 |
12795 |
397.4 |
-5.2 |
0.624 |
12 |
0 |
0 |
0.195 |
15 |
|
[AA5]B:401 |
24 |
1 |
558 |
f |
B |
x,y,z |
1_555 |
57 |
29 |
12807 |
395.8 |
-4.9 |
0.624 |
12 |
0 |
0 |
0.195 |
16 |
|
[AA5]G:401 |
24 |
1 |
560 |
f |
G |
x,y,z |
1_555 |
58 |
28 |
12788 |
395.1 |
-5.1 |
0.600 |
14 |
0 |
0 |
0.195 |
Average: |
399.1 |
-5.3 |
0.611 |
13 |
0 |
0 |
0.195 |
7 |
17 |
|
[AA5]H:401 |
24 |
1 |
563 |
f |
H |
x,y,z |
1_555 |
58 |
27 |
12824 |
402.1 |
-5.6 |
0.591 |
9 |
0 |
0 |
0.084 |
8 |
18 |
|
G |
45 |
15 |
12788 |
◊ |
B |
x,y,z |
1_555 |
28 |
7 |
12807 |
345.0 |
-2.9 |
0.346 |
2 |
2 |
0 |
0.000 |
9 |
19 |
|
D |
36 |
12 |
12797 |
◊ |
E |
x-1,y,z |
1_455 |
28 |
8 |
12848 |
268.0 |
1.6 |
0.766 |
6 |
1 |
0 |
0.000 |
10 |
20 |
|
G |
30 |
11 |
12788 |
◊ |
C |
x,y,z |
1_555 |
36 |
13 |
12762 |
242.9 |
-3.4 |
0.383 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
C |
31 |
9 |
12762 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
12782 |
231.2 |
-0.2 |
0.721 |
2 |
1 |
0 |
0.000 |
12 |
22 |
|
G |
17 |
5 |
12788 |
◊ |
A |
x,y,z |
1_555 |
21 |
5 |
12782 |
165.4 |
0.1 |
0.725 |
2 |
1 |
0 |
0.000 |
13 |
23 |
|
F |
24 |
7 |
12795 |
◊ |
D |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
18 |
5 |
12797 |
159.4 |
-2.0 |
0.411 |
0 |
0 |
0 |
0.000 |
14 |
24 |
|
H |
16 |
6 |
12824 |
◊ |
F |
-y,-x+1,-z-1/2 |
8_564 |
14 |
8 |
12795 |
137.0 |
-1.3 |
0.482 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
C |
17 |
6 |
12762 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
12807 |
136.7 |
-2.1 |
0.336 |
0 |
0 |
0 |
0.000 |
16 |
26 |
|
[SO4]H:403 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
20 |
8 |
12824 |
105.1 |
-15.2 |
0.674 |
2 |
0 |
0 |
0.141 |
17 |
27 |
|
[SO4]F:402 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
12795 |
95.3 |
-13.5 |
0.843 |
3 |
0 |
0 |
0.127 |
18 |
28 |
|
[SO4]E:402 |
5 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
12848 |
94.9 |
-13.3 |
0.813 |
3 |
0 |
0 |
0.125 |
19 |
29 |
|
[SO4]A:402 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
12782 |
92.5 |
-13.0 |
0.806 |
4 |
0 |
0 |
0.127 |
20 |
30 |
|
[SO4]C:402 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
12762 |
92.1 |
-12.7 |
0.851 |
2 |
0 |
0 |
0.120 |
21 |
31 |
|
[SO4]H:402 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
13 |
5 |
12824 |
92.1 |
-13.0 |
0.789 |
3 |
0 |
0 |
0.126 |
22 |
32 |
|
[SO4]D:402 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
12797 |
91.6 |
-12.7 |
0.776 |
1 |
0 |
0 |
0.115 |
23 |
33 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
12807 |
91.3 |
-12.8 |
0.786 |
2 |
0 |
0 |
0.118 |
24 |
34 |
|
[SO4]G:402 |
5 |
1 |
185 |
f |
G |
x,y,z |
1_555 |
13 |
5 |
12788 |
90.6 |
-12.2 |
0.847 |
3 |
0 |
0 |
0.119 |
25 |
35 |
|
[SO4]D:403 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
18 |
7 |
12797 |
89.8 |
-13.5 |
0.623 |
3 |
0 |
0 |
0.130 |
26 |
36 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
12807 |
89.6 |
-13.4 |
0.619 |
2 |
0 |
0 |
0.123 |
27 |
37 |
|
[SO4]A:403 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
12782 |
89.3 |
-13.0 |
0.616 |
3 |
0 |
0 |
0.123 |
28 |
38 |
|
[SO4]G:403 |
5 |
1 |
187 |
f |
G |
x,y,z |
1_555 |
18 |
6 |
12788 |
88.9 |
-13.0 |
0.614 |
2 |
0 |
0 |
0.121 |
29 |
39 |
|
[SO4]C:403 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
12762 |
88.1 |
-12.8 |
0.648 |
3 |
0 |
0 |
0.124 |
30 |
40 |
|
[SO4]E:403 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
17 |
7 |
12848 |
87.9 |
-13.2 |
0.608 |
2 |
0 |
0 |
0.121 |
31 |
41 |
|
[SO4]F:403 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
18 |
7 |
12795 |
86.4 |
-13.0 |
0.633 |
2 |
0 |
0 |
0.119 |
32 |
42 |
|
H |
6 |
2 |
12824 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
12762 |
72.2 |
-1.1 |
0.306 |
0 |
0 |
0 |
0.000 |
43 |
|
G |
6 |
2 |
12788 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
12797 |
58.0 |
-1.0 |
0.240 |
0 |
0 |
0 |
0.000 |
Average: |
65.1 |
-1.1 |
0.273 |
0 |
0 |
0 |
0.000 |
|