## |
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 |
|
O |
337 |
94 |
18199 |
◊ |
G |
x,y,z |
1_555 |
336 |
93 |
18211 |
3210.9 |
-32.4 |
0.043 |
48 |
16 |
1 |
0.712 |
2 |
|
M |
335 |
94 |
18164 |
◊ |
E |
x,y,z |
1_555 |
338 |
94 |
18221 |
3195.8 |
-33.5 |
0.035 |
47 |
16 |
1 |
0.712 |
3 |
|
I |
335 |
93 |
18230 |
◊ |
A |
x,y,z |
1_555 |
336 |
95 |
18221 |
3193.3 |
-33.7 |
0.034 |
48 |
16 |
1 |
0.712 |
4 |
|
K |
339 |
94 |
18208 |
◊ |
C |
x,y,z |
1_555 |
338 |
93 |
18231 |
3192.9 |
-33.1 |
0.037 |
46 |
16 |
1 |
0.712 |
Average: |
3198.2 |
-33.2 |
0.037 |
47 |
16 |
1 |
0.712 |
2 |
5 |
|
F |
147 |
34 |
7061 |
◊ |
E |
x,y,z |
1_555 |
171 |
40 |
18221 |
1446.5 |
-3.1 |
0.756 |
21 |
7 |
0 |
0.620 |
6 |
|
B |
153 |
33 |
7039 |
◊ |
A |
x,y,z |
1_555 |
169 |
42 |
18221 |
1444.1 |
-3.7 |
0.719 |
22 |
8 |
0 |
0.620 |
7 |
|
L |
159 |
34 |
6986 |
◊ |
M |
x,y,z |
1_555 |
170 |
41 |
18164 |
1443.5 |
-2.7 |
0.742 |
24 |
6 |
0 |
0.620 |
8 |
|
D |
151 |
34 |
7060 |
◊ |
C |
x,y,z |
1_555 |
163 |
40 |
18231 |
1435.8 |
-0.9 |
0.773 |
22 |
8 |
0 |
0.620 |
9 |
|
J |
156 |
34 |
7016 |
◊ |
K |
x,y,z |
1_555 |
165 |
40 |
18208 |
1427.6 |
-2.5 |
0.766 |
24 |
7 |
0 |
0.620 |
10 |
|
H |
152 |
34 |
7051 |
◊ |
G |
x,y,z |
1_555 |
164 |
40 |
18211 |
1425.8 |
-3.9 |
0.695 |
23 |
7 |
0 |
0.620 |
11 |
|
P |
148 |
34 |
6992 |
◊ |
I |
x,y,z |
1_555 |
164 |
40 |
18230 |
1420.3 |
-0.8 |
0.752 |
23 |
7 |
0 |
0.620 |
12 |
|
N |
152 |
34 |
6973 |
◊ |
O |
x,y,z |
1_555 |
167 |
42 |
18199 |
1415.8 |
-3.1 |
0.723 |
23 |
8 |
0 |
0.620 |
Average: |
1432.4 |
-2.6 |
0.741 |
23 |
7 |
0 |
0.620 |
3 |
13 |
|
C |
80 |
25 |
18231 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
77 |
25 |
18221 |
691.9 |
-8.8 |
0.153 |
2 |
8 |
0 |
0.045 |
14 |
|
E |
77 |
24 |
18221 |
◊ |
G |
-x+1,y-1/2,-z |
2_645 |
77 |
25 |
18211 |
683.3 |
-9.1 |
0.136 |
2 |
7 |
0 |
0.045 |
Average: |
687.6 |
-8.9 |
0.144 |
2 |
8 |
0 |
0.045 |
4 |
15 |
|
F |
60 |
16 |
7061 |
◊ |
G |
x,y,z |
1_555 |
70 |
20 |
18211 |
609.0 |
-2.9 |
0.521 |
7 |
1 |
0 |
0.113 |
16 |
|
J |
59 |
16 |
7016 |
◊ |
I |
x,y,z |
1_555 |
74 |
22 |
18230 |
608.6 |
-3.5 |
0.464 |
7 |
1 |
0 |
0.113 |
17 |
|
P |
63 |
17 |
6992 |
◊ |
O |
x,y,z |
1_555 |
71 |
20 |
18199 |
607.8 |
-2.6 |
0.535 |
9 |
1 |
0 |
0.113 |
18 |
|
B |
59 |
16 |
7039 |
◊ |
C |
x,y,z |
1_555 |
70 |
20 |
18231 |
607.7 |
-2.7 |
0.521 |
8 |
1 |
0 |
0.113 |
19 |
|
D |
58 |
16 |
7060 |
◊ |
E |
x,y,z |
1_555 |
72 |
21 |
18221 |
607.3 |
-2.4 |
0.536 |
8 |
1 |
0 |
0.113 |
20 |
|
L |
57 |
16 |
6986 |
◊ |
K |
x,y,z |
1_555 |
68 |
19 |
18208 |
606.0 |
-2.8 |
0.494 |
8 |
1 |
0 |
0.113 |
21 |
|
H |
57 |
16 |
7051 |
◊ |
A |
x,y,z |
1_555 |
69 |
19 |
18221 |
600.7 |
-2.7 |
0.473 |
9 |
1 |
0 |
0.113 |
22 |
|
N |
56 |
16 |
6973 |
◊ |
M |
x,y,z |
1_555 |
69 |
21 |
18164 |
600.1 |
-2.3 |
0.518 |
9 |
1 |
0 |
0.113 |
Average: |
605.9 |
-2.7 |
0.508 |
8 |
1 |
0 |
0.113 |
5 |
23 |
|
G |
45 |
13 |
18211 |
◊ |
E |
x,y,z |
1_555 |
54 |
18 |
18221 |
444.3 |
2.6 |
0.849 |
2 |
0 |
0 |
0.000 |
24 |
|
E |
45 |
13 |
18221 |
◊ |
C |
x,y,z |
1_555 |
55 |
18 |
18231 |
442.0 |
2.4 |
0.840 |
3 |
0 |
0 |
0.000 |
25 |
|
C |
46 |
13 |
18231 |
◊ |
A |
x,y,z |
1_555 |
53 |
17 |
18221 |
441.8 |
2.4 |
0.844 |
3 |
0 |
0 |
0.000 |
26 |
|
G |
56 |
17 |
18211 |
◊ |
A |
x,y,z |
1_555 |
46 |
14 |
18221 |
441.7 |
2.5 |
0.845 |
3 |
0 |
0 |
0.000 |
27 |
|
O |
44 |
13 |
18199 |
◊ |
I |
x,y,z |
1_555 |
57 |
18 |
18230 |
441.2 |
3.0 |
0.865 |
3 |
0 |
0 |
0.000 |
28 |
|
K |
55 |
18 |
18208 |
◊ |
I |
x,y,z |
1_555 |
45 |
13 |
18230 |
438.3 |
2.5 |
0.846 |
3 |
0 |
0 |
0.000 |
29 |
|
M |
55 |
17 |
18164 |
◊ |
K |
x,y,z |
1_555 |
44 |
13 |
18208 |
437.1 |
2.4 |
0.844 |
3 |
0 |
0 |
0.000 |
30 |
|
O |
55 |
17 |
18199 |
◊ |
M |
x,y,z |
1_555 |
46 |
13 |
18164 |
435.8 |
2.5 |
0.845 |
3 |
0 |
0 |
0.000 |
Average: |
440.3 |
2.5 |
0.847 |
3 |
0 |
0 |
0.000 |
6 |
31 |
|
K |
39 |
13 |
18208 |
◊ |
A |
x,y,z |
1_555 |
41 |
13 |
18221 |
413.5 |
-2.4 |
0.440 |
4 |
2 |
0 |
0.063 |
32 |
|
I |
40 |
13 |
18230 |
◊ |
G |
x,y,z |
1_555 |
39 |
13 |
18211 |
413.4 |
-2.6 |
0.422 |
4 |
2 |
0 |
0.063 |
33 |
|
M |
41 |
13 |
18164 |
◊ |
C |
x,y,z |
1_555 |
41 |
13 |
18231 |
413.0 |
-2.7 |
0.418 |
4 |
2 |
0 |
0.063 |
34 |
|
O |
41 |
13 |
18199 |
◊ |
E |
x,y,z |
1_555 |
41 |
13 |
18221 |
409.2 |
-2.4 |
0.445 |
4 |
2 |
0 |
0.063 |
Average: |
412.3 |
-2.5 |
0.431 |
4 |
2 |
0 |
0.063 |
7 |
35 |
|
N |
44 |
11 |
6973 |
◊ |
E |
x,y,z |
1_555 |
36 |
6 |
18221 |
372.6 |
-5.9 |
0.166 |
3 |
0 |
0 |
0.205 |
36 |
|
D |
45 |
10 |
7060 |
◊ |
M |
x,y,z |
1_555 |
37 |
7 |
18164 |
370.2 |
-5.8 |
0.198 |
3 |
0 |
0 |
0.205 |
37 |
|
H |
44 |
11 |
7051 |
◊ |
I |
x,y,z |
1_555 |
37 |
6 |
18230 |
369.1 |
-5.4 |
0.207 |
3 |
0 |
0 |
0.205 |
38 |
|
L |
44 |
12 |
6986 |
◊ |
C |
x,y,z |
1_555 |
39 |
7 |
18231 |
369.1 |
-5.6 |
0.194 |
3 |
0 |
0 |
0.205 |
39 |
|
F |
44 |
10 |
7061 |
◊ |
O |
x,y,z |
1_555 |
37 |
7 |
18199 |
368.5 |
-6.1 |
0.170 |
3 |
0 |
0 |
0.205 |
40 |
|
B |
45 |
11 |
7039 |
◊ |
K |
x,y,z |
1_555 |
38 |
7 |
18208 |
368.0 |
-6.0 |
0.182 |
3 |
0 |
0 |
0.205 |
41 |
|
J |
40 |
11 |
7016 |
◊ |
A |
x,y,z |
1_555 |
37 |
7 |
18221 |
363.9 |
-4.7 |
0.246 |
3 |
0 |
0 |
0.205 |
42 |
|
P |
44 |
11 |
6992 |
◊ |
G |
x,y,z |
1_555 |
36 |
6 |
18211 |
361.9 |
-5.5 |
0.197 |
3 |
0 |
0 |
0.205 |
Average: |
367.9 |
-5.6 |
0.195 |
3 |
0 |
0 |
0.205 |
8 |
43 |
|
J |
32 |
8 |
7016 |
◊ |
H |
x-1,y,z |
1_455 |
21 |
7 |
7051 |
199.7 |
-1.0 |
0.617 |
2 |
0 |
0 |
0.000 |
9 |
44 |
|
L |
21 |
8 |
6986 |
◊ |
J |
x,y,z |
1_555 |
15 |
4 |
7016 |
198.6 |
-0.3 |
0.654 |
4 |
2 |
0 |
0.028 |
45 |
|
P |
21 |
8 |
6992 |
◊ |
N |
x,y,z |
1_555 |
13 |
4 |
6973 |
195.3 |
-0.5 |
0.629 |
3 |
2 |
0 |
0.028 |
46 |
|
D |
14 |
4 |
7060 |
◊ |
B |
x,y,z |
1_555 |
22 |
8 |
7039 |
194.8 |
-0.2 |
0.692 |
4 |
2 |
0 |
0.028 |
47 |
|
P |
14 |
4 |
6992 |
◊ |
J |
x,y,z |
1_555 |
21 |
8 |
7016 |
192.4 |
-0.3 |
0.656 |
3 |
2 |
0 |
0.028 |
48 |
|
F |
13 |
4 |
7061 |
◊ |
D |
x,y,z |
1_555 |
22 |
8 |
7060 |
190.5 |
-0.2 |
0.693 |
4 |
2 |
0 |
0.028 |
49 |
|
H |
25 |
8 |
7051 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
7039 |
190.3 |
-0.4 |
0.663 |
3 |
2 |
0 |
0.028 |
50 |
|
H |
14 |
4 |
7051 |
◊ |
F |
x,y,z |
1_555 |
22 |
8 |
7061 |
189.5 |
-0.4 |
0.659 |
3 |
2 |
0 |
0.028 |
51 |
|
N |
22 |
8 |
6973 |
◊ |
L |
x,y,z |
1_555 |
14 |
4 |
6986 |
189.2 |
-0.1 |
0.694 |
4 |
2 |
0 |
0.028 |
Average: |
192.6 |
-0.3 |
0.667 |
4 |
2 |
0 |
0.028 |
10 |
52 |
|
L |
22 |
7 |
6986 |
◊ |
F |
x-1,y,z |
1_455 |
27 |
8 |
7061 |
186.8 |
-1.0 |
0.627 |
1 |
0 |
0 |
0.000 |
11 |
53 |
|
[CL]K:1460 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
12 |
6 |
18208 |
74.0 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.269 |
54 |
|
[CL]C:1460 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
18231 |
73.6 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.269 |
55 |
|
[CL]M:1461 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
12 |
7 |
18164 |
73.4 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.269 |
56 |
|
[CL]I:1460 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
13 |
7 |
18230 |
73.3 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.269 |
57 |
|
[CL]G:1460 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
12 |
6 |
18211 |
73.2 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.269 |
58 |
|
[CL]O:1460 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
12 |
7 |
18199 |
72.8 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.269 |
59 |
|
[CL]A:1460 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
18221 |
72.3 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.269 |
Average: |
73.2 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.269 |
12 |
60 |
|
[CL]A:1461 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
18221 |
70.7 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.380 |
61 |
|
[CL]K:1461 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
13 |
6 |
18208 |
70.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.380 |
62 |
|
[CL]G:1461 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
14 |
6 |
18211 |
70.0 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.380 |
63 |
|
[CL]E:1460 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
13 |
6 |
18221 |
69.7 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.380 |
64 |
|
[CL]C:1461 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
18231 |
69.6 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.380 |
65 |
|
[CL]I:1461 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
13 |
6 |
18230 |
69.3 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.380 |
66 |
|
[CL]M:1460 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
13 |
6 |
18164 |
69.1 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.380 |
67 |
|
[CL]O:1461 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
12 |
6 |
18199 |
67.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.380 |
Average: |
69.5 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.380 |
13 |
68 |
|
M |
2 |
1 |
18164 |
◊ |
P |
-x,y-1/2,-z |
2_545 |
1 |
1 |
6992 |
4.5 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
|