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. Author manuscript; available in PMC: 2017 Jun 24.
Published in final edited form as: J Chem Inf Model. 2016 May 24;56(6):1139–1151. doi: 10.1021/acs.jcim.5b00709

Table 5.

Kinase Targets in SARfari and Parameters for Building Homology Models

High Identity Homology Model Low Identity Homology Model

Symbol Template PDB Template Symbol Scorea Identitiesb Positivesc Gapsd Template PDB Template Symbol Scorea Identitiesb Positivesc Gapsd
AKT3 1GZN AKT2 485.3 87% 95% 0% 1UU9 PDPK1 186.4 39% 60% 0%
CDK1 4EK4 CDK2 406.8 64% 78% 3% 4G6O MAPK1 184.1 36% 53% 5%
CHUK 4KIK IKBKB 386.7 64% 77% 1% 4B9D NEK1 103.6 31% 52% 5%
CLK4 1Z57 CLK1 584.7 86% 92% 0% 1UKI MAPK8 108.6 29% 46% 15%
FLT4 3VID KDR 454.9 69% 79% 0% 4FOB ALK 165.2 33% 47% 19%
GSK3A 1J1B GSK3B 607.1 86% 93% 0% 3R71 CDK2 177.9 36% 58% 10%
LIMK2 3S95 LIMK1 408.3 69% 83% 2% 2J0L PTK2 105.1 27% 47% 15%
MAP3K8 3GGF STK26 145.2 34% 56% 5% 4FZA STK26 141.8 34% 56% 5%
PDGFRA 3HNG VEGFR1 340.1 47% 65% 9% 2RFN MET 43.5 31% 45% 9%
PDGFRB 1Y6A VEGFR2 323.6 46% 61% 10% 4F64 FGFR1 104.0 45% 61% 1%
PHKG1 2Y7J PHKG2 421.8 70% 85% 0% 3R2B MAPKAPK2 150.6 33% 52% 11%
PRKACG 2F7E PRKACA 473.4 86% 94% 0% 4EL9 RPS6KA3 200.3 37% 63% 2%
PRKCD 1XJD PRKCQ 512.3 72% 84% 0% 3NX8 PRKACA 191.0 40% 60% 1%
PRKCE 3TXO PRKCH 525.8 69% 82% 0% 3AMB PRKACA 203.8 40% 60% 2%
PRKCG 3IW4 PRKCA 559.7 75% 87% 1% 4L45 RPS6KB1 223.8 41% 63% 3%
PRKCZ 3ZH8 PRKCI 497.7 88% 94% 0% 3OTU PDPK1 162.9 33% 54% 4%
PRKD1 2W0J CHEK2 193.4 38% 60% 6% 4AE9 PRKACA 146.4 35% 57% 7%
PRKD3 2W0J CHEK2 194.1 39% 61% 6% 2GNL PRKACA 141.7 34% 55% 7%
RAF1 3D4Q BRAF 496.5 77% 89% 0% 2Y4I KSR2 162.9 35% 56% 5%
YES1 2H8H SRC 485.0 89% 95% 0% 3K54 BTK 218.8 40% 64% 0%

Mean 425.1 68% 81% 2% 156.1 35% 55% 6%
a

BLAST bit score;

b

Percentage of residues that are identical between the sequences;

c

Percentage of residues that are positive matches according to the similarity matrix;

d

Percentage of gaps in both query and homolog as returned by BLAST.