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1WRZ-B-A

PDB UniProt PubMed
PDB ID: 1WRZ
Structure method: X-RAY DIFFRACTION
Resolution: 2.0
Complex: 1WRZ-B
Peptide chain: B
Peptide length: 19
Protein chain: A
Protein length: 147

Description: Calmodulin complexed with a peptide from a human death-associated protein kinase 1WRZ

Protein

Peptide
Chain A B
Description calmodulin Death-associated protein kinase 2
Length (residues) 147 19
Molecular Weight (Da) 16635.145 2372.796
Isoelectric Point (pI) 4.087 12.0
Instability Index 28.193 90.979
Aliphatic Index 65.714 97.368
GRAVY -0.688 -0.379
Hydrophobic (%) 36.054 36.842
Positive Residues 14 5
Negative Residues 38 0
C, H, N, O, S 711, 1113, 187, 253, 9 105, 172, 36, 24, 1
Atomic Formula C711H1113N187O253S9 C105H172N36O24S1
Total Atoms 2273 338
Extinction Coeff. (with disulfide) 2980 5562
Extinction Coeff. (no disulfide) 2980 5625
Sequence 
DQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQ
NPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDS
EEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEV
DEMIREADIDGDGQVNYEEFVQMMTAK
 
RRRWKLSFSIVSLCNHLTR

Clustering classification

Unique: | Cluster leader: 1WRZ-B-A

PDB classification: METAL BINDING PROTEIN/TRANSFERASE

Contacts

Filter results:
Only side chain contacts
Contact Chain1 R1 Atom1 Chain2 R2 Atom2 Distance Local Type Show
E7/R303 A E7 OE1 B R303 NE 2.71 INTER SB
E7/R303 A E7 OE1 B R303 NE 2.71 INTER HB
E7/R303 A E7 OE1 B R303 NH2 3.43 INTER HB
E7/R303 A E7 OE1 B R303 NE 3.72 INTER HB
E7/R303 A E7 OE1 B R303 NH2 2.94 INTER HB
E7/R303 A E7 OE2 B R303 NE 2.87 INTER HB
E7/R303 A E7 OE2 B R303 NH2 3.58 INTER HB
E7/K306 A E7 OE1 B K306 NZ 5.67 INTER AT
A10/R303 A A10 O B R303 NH1 3.48 INTER HB
E11/R303 A E11 CG B R303 CG 3.44 INTER HY
E11/R303 A E11 OE1 B R303 NE 4.91 INTER AT
E11/K306 A E11 OE1 B K306 NZ 3.11 INTER SB
E11/K306 A E11 OE1 B K306 NZ 3.11 INTER HB
E11/K306 A E11 OE2 B K306 NZ 3.8 INTER HB
E14/R303 A E14 OE1 B R303 NH1 3.1 INTER SB
E14/R303 A E14 OE1 B R303 NH1 3.1 INTER HB
E14/L307 A E14 CG B L307 CG 4.41 INTER HY
E14/L307 A E14 CG B L307 CD1 4.39 INTER HY
A15/L307 A A15 CB B L307 CD2 3.89 INTER HY
A15/I311 A A15 CB B I311 CG1 4.24 INTER HY
A15/I311 A A15 CB B I311 CD1 3.89 INTER HY
L18/L307 A L18 CD1 B L307 CD1 3.94 INTER HY
L18/I311 A L18 CB B I311 CD1 4.41 INTER HY
L18/I311 A L18 CG B I311 CD1 4.26 INTER HY
L18/I311 A L18 CD1 B I311 CD1 3.15 INTER HY
F19/I311 A F19 CE2 B I311 CG1 4.23 INTER HY
F19/I311 A F19 CE2 B I311 CG2 4.08 INTER HY
F19/I311 A F19 CZ B I311 CG2 3.93 INTER HY
F19/L314 A F19 CE2 B L314 CD2 4.33 INTER HY
F19/L314 A F19 CZ B L314 CD2 4.06 INTER HY
L32/L318 A L32 CD1 B L318 CD1 4.43 INTER HY
V35/I311 A V35 CG1 B I311 CG2 4.29 INTER HY
M36/C315 A M36 CG B C315 CB 4.39 INTER HY
M36/L318 A M36 CE B L318 CB 3.68 INTER HY
M36/L318 A M36 CE B L318 CG 4.1 INTER HY
M36/L318 A M36 CE B L318 CD1 3.26 INTER HY
L39/V312 A L39 CD1 B V312 CG2 4.15 INTER HY
L39/V312 A L39 CD2 B V312 CG2 4.47 INTER HY
L39/C315 A L39 CD1 B C315 CB 4.05 INTER HY
Q41/C315 A Q41 NE2 B C315 O 3.77 INTER HB
Q41/T319 A Q41 CB B T319 CG2 4.42 INTER HY
Q41/T319 A Q41 CG B T319 CG2 4.46 INTER HY
Q41/T319 A Q41 OE1 B T319 OG1 3.7 INTER HB
Q41/T319 A Q41 NE2 B T319 OG1 2.41 INTER HB
M51/L318 A M51 CB B L318 CD2 4.37 INTER HY
M51/L318 A M51 CG B L318 CB 4.2 INTER HY
M51/L318 A M51 CG B L318 CD2 4.1 INTER HY
M51/L318 A M51 CE B L318 CB 4.35 INTER HY
M51/T319 A M51 CE B T319 CG2 4.35 INTER HY
E54/R320 A E54 OE1 B R320 NH1 5.63 INTER AT
F68/L314 A F68 CE1 B L314 CD2 4.37 INTER HY
M71/L314 A M71 CG B L314 CD1 4.3 INTER HY
K75/L314 A K75 CB B L314 CD1 3.49 INTER HY
K75/L314 A K75 CG B L314 CD1 4.47 INTER HY
K75/H317 A K75 O B H317 ND1 3.33 INTER HB
K75/H317 A K75 CB B H317 CB 4.44 INTER HY
K75/L318 A K75 CB B L318 CD2 4.4 INTER HY
K75/L318 A K75 CG B L318 CG 4.29 INTER HY
K75/L318 A K75 CG B L318 CD2 3.52 INTER HY
K75/R320 A K75 NZ B R320 NE 5.28 INTER RE
M76/S310 A M76 SD B S310 OG 3.61 INTER HB
M76/S313 A M76 SD B S313 OG 3.55 INTER HB
M76/L314 A M76 CB B L314 CB 4.42 INTER HY
M76/L314 A M76 CB B L314 CD1 4.16 INTER HY
M76/L314 A M76 CG B L314 CB 3.92 INTER HY
T79/H317 A T79 O B H317 NE2 3.56 INTER HB
D80/H317 A D80 N B H317 NE2 3.49 INTER HB
D80/H317 A D80 OD2 B H317 NE2 3.73 INTER uSB
D80/H317 A D80 OD2 B H317 NE2 3.73 INTER HB
E84/H317 A E84 OE1 B H317 NE2 5.35 INTER uAT
I85/F309 A I85 CG1 B F309 CE1 4.47 INTER HY
I85/F309 A I85 CG1 B F309 CZ 4.28 INTER HY
A88/F309 A A88 CB B F309 CD1 4.32 INTER HY
A88/F309 A A88 CB B F309 CE1 4.07 INTER HY
A88/V312 A A88 CB B V312 CG1 3.81 INTER HY
V91/V312 A V91 CB B V312 CG1 4.02 INTER HY
V91/V312 A V91 CG1 B V312 CG1 4.39 INTER HY
V91/V312 A V91 CG1 B V312 CG2 4.32 INTER HY
V91/V312 A V91 CG2 B V312 CG1 3.7 INTER HY
F92/W305 A F92 CD1 B W305 CZ3 4.09 INTER HY
F92/W305 A F92 CE1 B W305 CE3 4.27 INTER HY
F92/W305 A F92 CE1 B W305 CZ3 3.98 INTER HY
F92/V312 A F92 CE2 B V312 CB 4.39 INTER HY
F92/V312 A F92 CE2 B V312 CG2 3.96 INTER HY
F92/V312 A F92 CZ B V312 CG2 4.47 INTER HY
L105/W305 A L105 CG B W305 CH2 4.4 INTER HY
L105/W305 A L105 CD1 B W305 CE3 4.42 INTER HY
L105/W305 A L105 CD1 B W305 CZ2 4.22 INTER HY
L105/W305 A L105 CD1 B W305 CZ3 3.74 INTER HY
L105/W305 A L105 CD1 B W305 CH2 3.63 INTER HY
L105/W305 A L105 CD2 B W305 CZ2 3.87 INTER HY
L105/W305 A L105 CD2 B W305 CH2 3.98 INTER HY
L112/I311 A L112 CD2 B I311 CB 4.3 INTER HY
L112/I311 A L112 CD2 B I311 CG2 3.64 INTER HY
L112/V312 A L112 CD2 B V312 CG2 4.45 INTER HY
E114/R304 A E114 OE2 B R304 NH1 3.37 INTER SB
E114/R304 A E114 OE2 B R304 NH1 3.37 INTER HB
E120/R304 A E120 OE1 B R304 NH2 3.34 INTER SB
E120/R304 A E120 OE1 B R304 NH2 3.34 INTER HB
E120/R304 A E120 OE2 B R304 NH1 3.61 INTER HB
E120/R304 A E120 OE2 B R304 NH2 3.62 INTER HB
E123/R304 A E123 OE2 B R304 NE 5.82 INTER AT
M124/R304 A M124 CG B R304 CB 3.55 INTER HY
M124/R304 A M124 CG B R304 CG 3.85 INTER HY
M124/R304 A M124 CE B R304 CB 3.37 INTER HY
M124/W305 A M124 O B W305 NE1 2.89 INTER HB
M124/W305 A M124 CB B W305 CZ2 4.26 INTER HY
M124/W305 A M124 CE B W305 CB 4.25 INTER HY
M124/W305 A M124 CE B W305 CG 3.55 INTER HY
M124/W305 A M124 CE B W305 CD2 3.47 INTER HY
M124/W305 A M124 CE B W305 CE3 4.05 INTER HY
M124/W305 A M124 CE B W305 CZ2 4.2 INTER HY
E127/R302 A E127 OE1 B R302 N 3.34 INTER HB
E127/R302 A E127 OE1 B R302 NE 5.13 INTER AT
A128/W305 A A128 CB B W305 CZ2 3.98 INTER HY
V136/W305 A V136 CB B W305 CH2 4.44 INTER HY
V136/W305 A V136 CG1 B W305 CH2 4.46 INTER HY
V136/W305 A V136 CG2 B W305 CZ2 4.0 INTER HY
V136/W305 A V136 CG2 B W305 CH2 3.96 INTER HY
F141/W305 A F141 CD2 B W305 CE3 4.46 INTER HY
F141/W305 A F141 CD2 B W305 CZ3 4.08 INTER HY
F141/W305 A F141 CE2 B W305 CE3 4.32 INTER HY
F141/W305 A F141 CE2 B W305 CZ3 4.09 INTER HY
F141/F309 A F141 CE1 B F309 CD1 3.98 INTER HY
F141/F309 A F141 CE1 B F309 CE1 4.19 INTER HY
F141/F309 A F141 CZ B F309 CD1 3.82 INTER HY
F141/F309 A F141 CZ B F309 CE1 4.46 INTER HY
M144/R302 A M144 O B R302 NH1 3.4 INTER HB
M144/R302 A M144 SD B R302 NH1 3.23 INTER HB
M144/W305 A M144 CG B W305 CB 3.87 INTER HY
M144/W305 A M144 CG B W305 CG 3.58 INTER HY
M144/W305 A M144 CG B W305 CD2 3.99 INTER HY
M144/W305 A M144 CE B W305 CG 4.06 INTER HY
M145/W305 A M145 CE B W305 CB 3.91 INTER HY
M145/K306 A M145 CE B K306 CB 4.29 INTER HY
M145/F309 A M145 CG B F309 CB 4.3 INTER HY
M145/F309 A M145 CG B F309 CG 3.7 INTER HY
M145/F309 A M145 CG B F309 CD1 3.68 INTER HY
M145/F309 A M145 CG B F309 CD2 3.92 INTER HY
M145/F309 A M145 CG B F309 CE1 3.88 INTER HY
M145/F309 A M145 CG B F309 CE2 4.13 INTER HY
M145/F309 A M145 CG B F309 CZ 4.1 INTER HY
M145/F309 A M145 CE B F309 CB 3.45 INTER HY
M145/F309 A M145 CE B F309 CG 3.87 INTER HY
M145/F309 A M145 CE B F309 CD2 4.32 INTER HY
K148/K306 A K148 O B K306 NZ 3.41 INTER HB


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