2BWE

the crystal structure of the complex between the uba and ubl domains of dsk2

• Total interactions analyzed: 210
• Total true interactions: 36
• Strongest Interaction:
  • Chains: G-H
  • Int. Res.: 48
  • Norm. En. per Res.: -5.533
• Hub Node: C(6)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-8.144	-120.9255	-134.587	-263.6565	51	9	0	4901	7	19	16
B-C	-4.1575	-119.447	-138.714	-262.3184	50	6	0	4851	7	20	16
B-K	0.0	0.0	-0.0118	-0.0118	2	0	0	6	0	0	0
C-D	-8.8986	-98.2281	-141.449	-248.5757	52	5	0	4934	6	21	19
C-J	0.0	0.0	-0.0131	-0.0131	2	0	0	7	0	0	0
C-K	0.0	21.8203	-50.9149	-29.0946	32	9	2	2845	0	2	4
C-L	0.0	0.0	-6.2029	-6.2029	7	0	0	273	0	0	2
C-S	0.0	-4.4756	-28.7032	-33.1788	23	5	0	1399	0	9	9
C-T	0.0	0.0	-0.1357	-0.1357	7	0	0	39	0	1	0
D-E	-29.5879	-88.0204	-132.122	-249.7303	48	8	0	5020	3	18	16
D-K	0.0	0.0	-6.0209	-6.0209	7	0	0	263	0	0	1
D-T	-13.7533	-34.4595	-78.2067	-126.4194	39	6	2	3505	2	11	6
E-F	0.0	-117.0214	-151.527	-268.5484	51	5	0	4999	7	21	17
E-T	0.0	0.0	-2.0713	-2.0713	10	0	0	196	0	2	0
F-G	0.0	-114.7445	-145.039	-259.7835	50	5	0	4847	8	20	17
G-H	-5.8194	-118.2074	-141.558	-265.5847	48	5	0	4851	7	21	16
H-I	-2.1912	-113.7953	-146.148	-262.1346	49	5	0	4922	8	20	16
J-K	-6.5546	-115.2157	-141.446	-263.2164	50	6	0	4848	7	20	16
K-L	-6.5098	-117.3867	-145.38	-269.2765	51	5	0	4903	7	22	19
K-S	0.0	0.0	-0.1322	-0.1322	7	0	0	37	0	1	0
K-T	0.0	-5.1555	-25.1583	-30.3137	22	5	0	1140	0	9	9
L-M	-30.9966	-87.2622	-138.509	-256.7678	47	11	0	5024	3	18	16
L-R	0.0	0.0	-1.0345	-1.0345	3	0	0	76	0	0	0
L-S	-15.0344	-33.2636	-80.2427	-128.5407	39	6	2	3494	2	11	6
M-Q	0.0	0.0	-0.566	-0.566	3	0	0	58	0	0	0
M-R	0.0	0.0	-40.3164	-40.3164	28	0	0	2061	0	0	3
M-S	0.0	0.0	-1.8547	-1.8547	9	0	0	185	0	2	0
M-U	0.0	0.0	-22.9358	-22.9358	18	1	0	1188	0	1	2
N-O	0.0	-114.7354	-147.777	-262.5124	50	5	0	4943	8	21	17
O-P	0.0	-116.8798	-140.055	-256.9348	47	4	0	4804	7	21	16
P-Q	-7.0607	-115.9176	-147.257	-270.2353	50	6	0	4989	7	21	17
P-U	0.0	0.0	-0.2246	-0.2246	7	0	0	43	0	0	0
Q-R	-28.6327	-91.8909	-140.124	-260.6476	48	9	0	5039	3	18	15
Q-U	-15.2397	-33.6737	-79.2534	-128.1669	39	8	2	3541	2	11	6
R-S	0.0	0.0	-29.1984	-29.1984	21	0	0	1316	0	1	2
R-U	0.0	0.0	-2.6116	-2.6116	10	0	0	222	0	2	0

Interface residues

• A-B: ALA352A, ALA353A, ALA364A, ARG331A, ARG331B, ARG337B, ARG349B, ARG355A, ARG356A, ASN340B, ASN350B, ASN370A, ASP327B, ASP341B, ASP346B, ASP348B, ASP366A, GLN335A, GLN335B, GLN338B, GLN362A, GLU329B, GLU330B, GLU333B, GLY343B, GLY358A, GLY359A, GLY363A, GLY371A, HIS334A, HIS334B, LEU326A, LEU326B, LEU336B, LEU339B, LEU354A, LEU365A, LEU368A, MET342B, PHE344B, PHE345B, PHE347B, PRO328B, SER357A, SER360A, SER367A, TYR332A, TYR332B, VAL351A, VAL351B, VAL361A
• B-C: ALA352B, ALA353B, ALA364B, ARG331B, ARG331C, ARG337C, ARG349C, ARG355B, ARG356B, ASN340C, ASN350C, ASN370B, ASP327C, ASP341C, ASP346C, ASP348C, ASP366B, GLN335B, GLN335C, GLN338B, GLN338C, GLN362B, GLU329C, GLU330C, GLU333C, GLY343C, GLY358B, GLY359B, GLY363B, HIS334B, HIS334C, LEU326C, LEU336C, LEU339C, LEU354B, LEU365B, MET342C, PHE344C, PHE345C, PHE347C, PRO328B, PRO328C, SER357B, SER360B, SER367B, TYR332B, TYR332C, VAL351B, VAL351C, VAL361B
• B-K: ASP341K, GLN362B
• C-D: ALA352C, ALA353C, ALA364C, ARG331C, ARG331D, ARG337D, ARG349D, ARG355C, ARG356C, ASN340D, ASN350D, ASN370C, ASP327D, ASP341D, ASP346D, ASP348D, ASP366C, ASP372C, GLN335C, GLN335D, GLN338C, GLN338D, GLN362C, GLU329D, GLU330D, GLU333D, GLY343D, GLY358C, GLY359C, GLY363C, HIS334C, HIS334D, LEU326D, LEU336D, LEU339D, LEU354C, LEU365C, LEU368C, MET342D, PHE344D, PHE345D, PHE347D, PRO328D, SER357C, SER360C, SER367C, TYR332C, TYR332D, VAL351C, VAL351D, VAL361C, VAL373C
• C-J: ASP341C, GLN362J
• C-K: ALA364C, ALA364K, ASN370C, ASN370K, ASP341C, ASP341K, ASP366C, ASP366K, GLN338C, GLN338K, GLN362C, GLN362K, GLY343C, GLY343K, GLY363C, GLY363K, LEU339C, LEU339K, LEU365C, LEU365K, LEU368C, LEU368K, LEU369C, LEU369K, MET342C, MET342K, PHE344C, PHE344K, SER367C, SER367K, VAL361C, VAL361K
• C-L: ASN370C, ASP366C, GLY343L, GLY371C, LEU368C, LEU369C, PHE345L
• C-S: ALA352C, ARG349C, ARG356C, ASN370C, ASP346C, ASP372C, ASP64S, GLN63S, GLY371C, GLY48S, HIS61S, HIS66S, ILE62S, LEU368C, LEU369C, LYS49S, PHE344C, SER367C, SER47S, SER59S, TYR46S, TYR60S, VAL373C
• C-T: GLN362C, GLY48T, HIS66T, HIS69T, SER47T, SER67T, TYR46T
• D-E: ALA352D, ALA353D, ALA364D, ARG331D, ARG331E, ARG337E, ARG355D, ARG356D, ASN340E, ASN350E, ASN370D, ASP327E, ASP341E, ASP346E, ASP348E, ASP366D, GLN335D, GLN335E, GLN338D, GLN338E, GLN362D, GLU329E, GLU330E, GLU333E, GLY343E, GLY358D, GLY359D, GLY363D, HIS334D, HIS334E, LEU326D, LEU336D, LEU336E, LEU339E, LEU354D, LEU365D, MET342E, PHE344E, PHE345E, PHE347E, PRO328E, SER357D, SER360D, SER367D, TYR332D, TYR332E, VAL351E, VAL361D
• D-K: ASN370K, ASP366K, GLY343D, GLY371K, LEU368K, LEU369K, PHE345D
• D-T: ARG337D, ARG349D, ARG43T, ASN340D, ASN370D, ASP341D, ASP366D, GLN338D, GLN362D, GLN74T, GLY10T, GLY343D, GLY363D, GLY48T, HIS69T, ILE45T, ILE50T, LEU339D, LEU365D, LEU368D, LEU369D, LEU44T, LEU51T, LEU70T, LYS49T, LYS72T, LYS8T, MET342D, PHE344D, PHE345D, SER367D, SER47T, SER67T, SER73T, SER9T, TYR46T, VAL361D, VAL68T, VAL71T
• E-F: ALA352E, ALA353E, ALA364E, ARG331E, ARG331F, ARG337F, ARG349F, ARG355E, ARG356E, ASN340F, ASN350F, ASN370E, ASP327F, ASP341F, ASP346F, ASP348F, ASP366E, GLN335E, GLN335F, GLN338E, GLN338F, GLN362E, GLU329F, GLU330F, GLU333F, GLY343F, GLY358E, GLY359E, GLY363E, GLY371E, HIS334E, HIS334F, LEU336F, LEU339F, LEU354E, LEU365E, LEU368E, MET342F, PHE344F, PHE345F, PHE347F, PRO328E, PRO328F, SER357E, SER360E, SER367E, TYR332E, TYR332F, VAL351E, VAL351F, VAL361E
• E-T: ARG43T, ASP341E, GLN74T, GLY343E, LYS72T, MET342E, PHE344E, PHE345E, SER73T, VAL71T
• F-G: ALA352F, ALA353F, ALA364F, ARG331F, ARG331G, ARG337G, ARG349G, ARG355F, ARG356F, ASN340G, ASN350G, ASN370F, ASP327G, ASP341G, ASP346G, ASP348G, ASP366F, GLN335F, GLN335G, GLN338F, GLN338G, GLN362F, GLU329G, GLU330G, GLU333G, GLY343G, GLY358F, GLY359F, GLY363F, HIS334F, HIS334G, LEU326G, LEU336G, LEU339G, LEU354F, LEU365F, MET342G, PHE344G, PHE345G, PHE347G, PRO328F, PRO328G, SER357F, SER360F, SER367F, TYR332F, TYR332G, VAL351F, VAL351G, VAL361F
• G-H: ALA352G, ALA353G, ALA364G, ARG331G, ARG331H, ARG337H, ARG349H, ARG355G, ARG356G, ASN340H, ASN350H, ASN370G, ASP327H, ASP341H, ASP346H, ASP348H, ASP366G, GLN335G, GLN335H, GLN338G, GLN338H, GLN362G, GLU329H, GLU330H, GLU333H, GLY343H, GLY358G, GLY359G, GLY363G, HIS334G, HIS334H, LEU336H, LEU339H, LEU354G, LEU365G, MET342H, PHE344H, PHE345H, PHE347H, PRO328H, SER357G, SER360G, SER367G, TYR332G, TYR332H, VAL351G, VAL351H, VAL361G
• H-I: ALA352H, ALA353H, ALA364H, ARG331H, ARG331I, ARG337I, ARG349I, ARG355H, ARG356H, ASN340I, ASN350I, ASN370H, ASP327I, ASP341I, ASP346I, ASP348I, ASP366H, GLN335H, GLN335I, GLN338H, GLN338I, GLN362H, GLU329I, GLU330I, GLU333I, GLY343I, GLY358H, GLY359H, GLY363H, HIS334H, HIS334I, LEU336I, LEU339I, LEU354H, LEU365H, MET342I, PHE344I, PHE345I, PHE347I, PRO328H, PRO328I, SER357H, SER360H, SER367H, TYR332H, TYR332I, VAL351H, VAL351I, VAL361H
• J-K: ALA352J, ALA353J, ALA364J, ARG331J, ARG331K, ARG337K, ARG349K, ARG355J, ARG356J, ASN340K, ASN350K, ASN370J, ASP327K, ASP341K, ASP346K, ASP348K, ASP366J, GLN335J, GLN335K, GLN338J, GLN338K, GLN362J, GLU329K, GLU330K, GLU333K, GLY343K, GLY358J, GLY359J, GLY363J, HIS334J, HIS334K, LEU326K, LEU336K, LEU339K, LEU354J, LEU365J, MET342K, PHE344K, PHE345K, PHE347K, PRO328J, PRO328K, SER357J, SER360J, SER367J, TYR332J, TYR332K, VAL351J, VAL351K, VAL361J
• K-L: ALA352K, ALA353K, ALA364K, ARG331K, ARG331L, ARG337L, ARG349L, ARG355K, ARG356K, ASN340L, ASN350L, ASN370K, ASP327L, ASP341L, ASP346L, ASP348L, ASP366K, ASP372K, GLN335K, GLN335L, GLN338K, GLN338L, GLN362K, GLU329L, GLU330L, GLU333L, GLY343L, GLY358K, GLY359K, GLY363K, HIS334K, HIS334L, LEU326L, LEU336L, LEU339L, LEU354K, LEU365K, LEU368K, MET342L, PHE344L, PHE345L, PHE347L, PRO328L, SER357K, SER360K, SER367K, TYR332K, TYR332L, VAL351K, VAL351L, VAL361K
• K-S: GLN362K, GLY48S, HIS66S, HIS69S, SER47S, SER67S, TYR46S
• K-T: ALA352K, ARG349K, ARG356K, ASN370K, ASP346K, ASP372K, ASP64T, GLN63T, GLY371K, GLY48T, HIS61T, HIS66T, ILE62T, LEU368K, LEU369K, LYS49T, PHE344K, SER367K, SER47T, SER59T, TYR46T, TYR60T
• L-M: ALA352L, ALA353L, ALA364L, ARG331L, ARG331M, ARG337M, ARG355L, ARG356L, ASN340M, ASN350M, ASN370L, ASP327M, ASP341M, ASP346M, ASP348M, ASP366L, GLN335L, GLN335M, GLN338L, GLN338M, GLN362L, GLU329M, GLU330M, GLU333M, GLY343M, GLY358L, GLY359L, GLY363L, HIS334L, HIS334M, LEU336L, LEU336M, LEU339M, LEU354L, LEU365L, MET342M, PHE344M, PHE345M, PHE347M, PRO328M, SER357L, SER360L, SER367L, TYR332L, TYR332M, VAL351M, VAL361L
• L-R: ASN370R, GLN362L, LEU369R
• L-S: ARG337L, ARG349L, ARG43S, ASN340L, ASN370L, ASP341L, ASP366L, GLN338L, GLN362L, GLN74S, GLY10S, GLY343L, GLY363L, GLY48S, HIS69S, ILE45S, ILE50S, LEU339L, LEU365L, LEU368L, LEU369L, LEU44S, LEU51S, LEU70S, LYS49S, LYS72S, LYS8S, MET342L, PHE344L, PHE345L, SER367L, SER47S, SER67S, SER73S, SER9S, TYR46S, VAL361L, VAL68S, VAL71S
• M-Q: ASN370M, GLN362Q, LEU369M
• M-R: ASN340M, ASN370M, ASN370R, ASP341M, ASP341R, ASP366M, ASP366R, GLN338M, GLN338R, GLN362M, GLN362R, GLY343M, GLY343R, LEU339M, LEU339R, LEU365M, LEU365R, LEU368M, LEU368R, LEU369M, LEU369R, MET342M, MET342R, PHE344M, PHE344R, PHE345M, SER367M, SER367R
• M-S: ARG43S, ASP341M, GLN74S, GLY343M, LYS72S, MET342M, PHE345M, SER73S, VAL71S
• M-U: ALA40U, ARG349M, ARG356M, ASN35U, ASN370M, ASN41U, GLN74U, GLY36U, GLY371M, ILE37U, LEU368M, LEU369M, LYS72U, PHE344M, PRO38U, SER367M, SER73U, VAL71U
• N-O: ALA352N, ALA353N, ALA364N, ARG331N, ARG331O, ARG337O, ARG349O, ARG355N, ARG356N, ASN340O, ASN350O, ASN370N, ASP327O, ASP341O, ASP346O, ASP348O, ASP366N, GLN335N, GLN335O, GLN338N, GLN338O, GLN362N, GLU329O, GLU330O, GLU333O, GLY343O, GLY358N, GLY359N, GLY363N, HIS334N, HIS334O, LEU326O, LEU336O, LEU339O, LEU354N, LEU365N, MET342O, PHE344O, PHE345O, PHE347O, PRO328N, PRO328O, SER357N, SER360N, SER367N, TYR332N, TYR332O, VAL351N, VAL351O, VAL361N
• O-P: ALA352O, ALA353O, ALA364O, ARG331O, ARG331P, ARG337P, ARG349P, ARG355O, ARG356O, ASN340P, ASN350P, ASN370O, ASP327P, ASP341P, ASP346P, ASP348P, ASP366O, GLN335O, GLN335P, GLN338O, GLN338P, GLN362O, GLU329P, GLU330P, GLU333P, GLY343P, GLY358O, GLY359O, GLY363O, HIS334P, LEU336P, LEU339P, LEU354O, LEU365O, MET342P, PHE344P, PHE345P, PHE347P, PRO328P, SER357O, SER360O, SER367O, TYR332O, TYR332P, VAL351O, VAL351P, VAL361O
• P-Q: ALA352P, ALA353P, ALA364P, ARG331P, ARG331Q, ARG337Q, ARG349Q, ARG355P, ARG356P, ASN340Q, ASN350Q, ASN370P, ASP327Q, ASP341Q, ASP346Q, ASP348Q, ASP366P, GLN335P, GLN335Q, GLN338P, GLN338Q, GLN362P, GLU329Q, GLU330Q, GLU333Q, GLY343Q, GLY358P, GLY359P, GLY363P, HIS334P, HIS334Q, LEU326Q, LEU336Q, LEU339Q, LEU354P, LEU365P, MET342Q, PHE344Q, PHE345Q, PHE347Q, PRO328P, PRO328Q, SER357P, SER360P, SER367P, TYR332P, TYR332Q, VAL351P, VAL351Q, VAL361P
• P-U: GLN362P, GLY48U, HIS66U, HIS69U, SER47U, SER67U, TYR46U
• Q-R: ALA352Q, ALA353Q, ALA364Q, ARG331Q, ARG331R, ARG337R, ARG355Q, ARG356Q, ASN340R, ASN350R, ASN370Q, ASP327R, ASP341R, ASP346R, ASP348R, ASP366Q, GLN335Q, GLN335R, GLN338Q, GLN338R, GLN362Q, GLU329R, GLU330R, GLU333R, GLY343R, GLY358Q, GLY359Q, GLY363Q, HIS334Q, HIS334R, ILE325Q, LEU336Q, LEU336R, LEU339R, LEU354Q, LEU365Q, MET342R, PHE344R, PHE345R, PHE347R, PRO328R, SER357Q, SER360Q, SER367Q, TYR332Q, TYR332R, VAL351R, VAL361Q
• Q-U: ARG337Q, ARG349Q, ARG43U, ASN340Q, ASN370Q, ASP341Q, ASP366Q, GLN338Q, GLN362Q, GLN74U, GLY10U, GLY343Q, GLY363Q, GLY48U, HIS69U, ILE45U, ILE50U, LEU339Q, LEU365Q, LEU368Q, LEU369Q, LEU44U, LEU51U, LEU70U, LYS49U, LYS72U, LYS8U, MET342Q, PHE344Q, PHE345Q, SER367Q, SER47U, SER67U, SER73U, SER9U, TYR46U, VAL361Q, VAL68U, VAL71U
• R-S: ALA352R, ALA40S, ARG349R, ARG356R, ASN35S, ASN370R, ASN41S, ASP346R, GLN42S, GLN74S, GLY36S, GLY371R, ILE37S, LEU368R, LEU369R, LYS72S, PHE344R, PRO38S, SER367R, SER73S, VAL71S
• R-U: ARG43U, ASP341R, GLN74U, GLY343R, LYS72U, MET342R, PHE344R, PHE345R, SER73U, VAL71U