SitesBLAST
Comparing WP_012411972.1 NCBI__GCF_000020025.1:WP_012411972.1 to proteins with known functional sites using BLASTp with E ≤ 0.001.
Or try Sites on a Tree, PaperBLAST, Conserved Domains, or compare to all protein structures
Found 20 (the maximum) hits to proteins with known functional sites (download)
Q9KNV2 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Vibrio cholerae serotype O1 (strain ATCC 39315 / El Tor Inaba N16961)
45% identity, 98% coverage: 5:361/363 of query aligns to 4:356/361 of Q9KNV2
U3KRF2 3-dehydroquinate synthase, chloroplastic; EC 4.2.3.4 from Actinidia chinensis var. chinensis (Chinese soft-hair kiwi) (see paper)
47% identity, 93% coverage: 3:338/363 of query aligns to 82:416/445 of U3KRF2
3zokA Structure of 3-dehydroquinate synthase from actinidia chinensis in complex with NAD (see paper)
47% identity, 93% coverage: 3:338/363 of query aligns to 2:336/365 of 3zokA
- active site: R122 (= R122), K144 (= K144), E186 (= E186), K228 (= K230), E238 (= E240), R242 (= R244), N246 (= N248), H249 (= H251), H253 (= H255), H266 (= H268)
- binding glycine: K144 (= K144), K228 (= K230), R242 (= R244)
- binding nicotinamide-adenine-dinucleotide: T44 (= T46), V45 (≠ I47), D73 (≠ P73), E75 (= E75), K78 (= K78), G106 (= G106), G107 (= G107), V108 (= V108), D111 (= D111), T131 (= T131), T132 (= T132), M134 (≠ L134), D138 (= D138), S139 (= S139), K144 (= K144), K153 (= K153), T174 (= T174), L175 (= L175), E179 (= E179), H266 (= H268)
3okfA 2.5 angstrom resolution crystal structure of 3-dehydroquinate synthase (arob) from vibrio cholerae
45% identity, 98% coverage: 5:361/363 of query aligns to 5:355/360 of 3okfA
- active site: R120 (= R122), K142 (= K144), E184 (= E186), K226 (= K230), R238 (= R244), N242 (= N248), H245 (= H251), H249 (= H255), H262 (= H268)
- binding nicotinamide-adenine-dinucleotide: N42 (= N44), L48 (≠ H50), D71 (≠ P73), E73 (= E75), K76 (= K78), G104 (= G106), G105 (= G107), V106 (= V108), D109 (= D111), T129 (= T131), T130 (= T132), L132 (= L134), D136 (= D138), T172 (= T174), L173 (= L175), E177 (= E179)
6llaB Crystal structure of providencia alcalifaciens 3-dehydroquinate synthase (dhqs) in complex with mg2+ and NAD (see paper)
47% identity, 93% coverage: 5:343/363 of query aligns to 5:341/363 of 6llaB
- active site: R121 (= R122), K143 (= K144), E185 (= E186), K227 (= K230), E237 (= E240), R242 (= R244), N246 (= N248), H249 (= H251), H253 (= H255), H266 (= H268)
- binding magnesium ion: E185 (= E186), H249 (= H251), H266 (= H268)
- binding nicotinamide-adenine-dinucleotide: L46 (≠ I47), D72 (≠ P73), E74 (= E75), K77 (= K78), G105 (= G106), G106 (= G107), V107 (= V108), D110 (= D111), T130 (= T131), T131 (= T132), L133 (= L134), D137 (= D138), K143 (= K144), T173 (= T174), L174 (= L175), E178 (= E179)
6lk2A Crystal structure of providencia alcalifaciens 3-dehydroquinate synthase (dhqs) in complex with mg2+, NAD and chlorogenic acid (see paper)
47% identity, 93% coverage: 5:343/363 of query aligns to 5:337/357 of 6lk2A
- active site: R121 (= R122), K143 (= K144), E185 (= E186), K227 (= K230), R238 (= R244), N242 (= N248), H245 (= H251), H249 (= H255), H262 (= H268)
- binding (1R,3R,4S,5R)-3-[3-[3,4-bis(oxidanyl)phenyl]propanoyloxy]-1,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid: D137 (= D138), E185 (= E186), K227 (= K230), R238 (= R244), N242 (= N248), H245 (= H251), T246 (= T252), H249 (= H255), H262 (= H268)
- binding magnesium ion: E185 (= E186), H245 (= H251), H262 (= H268)
- binding nicotinamide-adenine-dinucleotide: L46 (≠ I47), D72 (≠ P73), E74 (= E75), K77 (= K78), G105 (= G106), G106 (= G107), V107 (= V108), D110 (= D111), T130 (= T131), T131 (= T132), L133 (= L134), D137 (= D138), S138 (= S139), C170 (≠ V171), T173 (= T174), L174 (= L175), P175 (= P176), E178 (= E179)
5eksA Structure of 3-dehydroquinate synthase from acinetobacter baumannii in complex with NAD
43% identity, 98% coverage: 5:360/363 of query aligns to 5:349/355 of 5eksA
- active site: R120 (= R122), K142 (= K144), E184 (= E186), K226 (= K230), R237 (= R244), N241 (= N248), H244 (= H251), H248 (= H255), H261 (= H268)
- binding magnesium ion: E184 (= E186), H244 (= H251), H261 (= H268)
- binding nicotinamide-adenine-dinucleotide: N42 (= N44), V45 (≠ I47), D71 (≠ P73), E73 (= E75), K76 (= K78), G104 (= G106), G105 (= G107), V106 (= V108), D109 (= D111), T129 (= T131), T130 (= T132), D136 (= D138), S137 (= S139), K142 (= K144), T172 (= T174), L173 (= L175), E177 (= E179)
P56081 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacter pylori) (see paper)
40% identity, 98% coverage: 5:361/363 of query aligns to 4:340/343 of P56081
Q5NFS1 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4)
42% identity, 88% coverage: 36:355/363 of query aligns to 34:351/359 of Q5NFS1
5hvnA 3.0 angstrom crystal structure of 3-dehydroquinate synthase (arob) from francisella tularensis in complex with NAD.
40% identity, 88% coverage: 36:355/363 of query aligns to 37:346/354 of 5hvnA
- active site: R123 (= R122), K145 (= K144), E187 (= E186), K228 (= K230), R239 (= R244), N243 (= N248), H246 (= H251), H250 (= H255), H263 (= H268)
- binding nicotinamide-adenine-dinucleotide: N45 (= N44), L51 (≠ H50), D73 (≠ P73), E75 (= E75), K78 (= K78), G107 (= G106), G108 (= G107), V109 (= V108), D112 (= D111), T132 (= T131), T133 (= T132), L135 (= L134), D139 (= D138), K145 (= K144), F172 (≠ V171), T175 (= T174), L176 (= L175), E180 (= E179)
3clhA Crystal structure of 3-dehydroquinate synthase (dhqs)from helicobacter pylori (see paper)
37% identity, 98% coverage: 5:361/363 of query aligns to 1:305/308 of 3clhA
- active site: R107 (= R122), K129 (= K144), E171 (= E186), K207 (= K230), R212 (= R244), N216 (= N248), H219 (= H251), H223 (= H255), H236 (= H268)
- binding nicotinamide-adenine-dinucleotide: I33 (≠ T46), V34 (≠ I47), H38 (≠ Y51), S58 (≠ P73), E60 (= E75), K63 (= K78), G91 (= G106), G92 (= G107), V93 (= V108), D96 (= D111), T116 (= T131), T117 (= T132), L119 (= L134), D123 (= D138), A124 (≠ S139), K129 (= K144), N139 (= N154), T159 (= T174), L160 (= L175), E164 (= E179)
6hqvA Pentafunctional arom complex from chaetomium thermophilum (see paper)
43% identity, 75% coverage: 71:343/363 of query aligns to 72:365/1555 of 6hqvA
- active site: R123 (= R122), K145 (= K144), E187 (= E186), K243 (= K230), E253 (= E240), R257 (= R244), N261 (= N248), H264 (= H251), H268 (= H255), H280 (= H268)
- binding glutamic acid: D139 (= D138), K145 (= K144), E187 (= E186), K243 (= K230), R257 (= R244), H264 (= H251), H280 (= H268)
- binding nicotinamide-adenine-dinucleotide: E76 (= E75), K79 (= K78), G107 (= G106), G108 (= G107), V109 (= V108), D112 (= D111), T132 (= T131), T133 (= T132), L135 (= L134), D139 (= D138), S140 (= S139), K145 (= K144), K154 (= K153), T175 (= T174), L176 (= L175), P177 (= P176), E180 (= E179), H280 (= H268)
- binding zinc ion: E187 (= E186), H264 (= H251), H280 (= H268)
Sites not aligning to the query:
- binding (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid: 1060, 1062, 1181, 1224, 1232, 1242, 1243
- binding nicotinamide-adenine-dinucleotide: 42, 44, 45
- binding (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid: 413, 562, 563, 874, 923, 924, 979, 1277, 1279, 1323, 1327, 1348, 1368, 1526
6c5cA Crystal structure of the 3-dehydroquinate synthase (dhqs) domain of aro1 from candida albicans sc5314 in complex with nadh (see paper)
43% identity, 75% coverage: 70:343/363 of query aligns to 78:365/385 of 6c5cA
- active site: R130 (= R122), K152 (= K144), E194 (= E186), K246 (= K230), E254 (= E240), R258 (= R244), N262 (= N248), H265 (= H251), H269 (= H255), H281 (= H268)
- binding nicotinamide-adenine-dinucleotide: E83 (= E75), K86 (= K78), G114 (= G106), G115 (= G107), V116 (= V108), D119 (= D111), T139 (= T131), T140 (= T132), D146 (= D138), S147 (= S139), F179 (≠ V171), T182 (= T174), L183 (= L175), Q187 (≠ E179)
Sites not aligning to the query:
P9WPX9 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
42% identity, 83% coverage: 38:338/363 of query aligns to 39:334/362 of P9WPX9
1dqsA Crystal structure of dehydroquinate synthase (dhqs) complexed with carbaphosphonate, NAD+ and zn2+ (see paper)
43% identity, 75% coverage: 72:343/363 of query aligns to 75:362/381 of 1dqsA
- active site: R127 (= R122), K149 (= K144), E191 (= E186), K240 (= K230), E250 (= E240), R254 (= R244), N258 (= N248), H261 (= H251), H265 (= H255), H277 (= H268)
- binding [1r-(1alpha,3beta,4alpha,5beta)]-5-(phosphonomethyl)-1,3,4-trihydroxycyclohexane-1-carboxylic acid: D143 (= D138), K149 (= K144), N159 (= N154), E191 (= E186), K240 (= K230), R254 (= R244), L257 (= L247), N258 (= N248), H261 (= H251), H265 (= H255), H277 (= H268), K346 (= K327)
- binding nicotinamide-adenine-dinucleotide: E78 (= E75), K81 (= K78), G111 (= G106), G112 (= G107), V113 (= V108), D116 (= D111), T136 (= T131), T137 (= T132), L139 (= L134), D143 (= D138), S144 (= S139), K158 (= K153), T179 (= T174), P181 (= P176), E184 (= E179), H277 (= H268)
- binding zinc ion: E191 (= E186), H261 (= H251), H277 (= H268)
Sites not aligning to the query:
P07547 Pentafunctional AROM polypeptide; EC 4.2.3.4; EC 2.5.1.19; EC 2.7.1.71; EC 4.2.1.10; EC 1.1.1.25 from Emericella nidulans (strain FGSC A4 / ATCC 38163 / CBS 112.46 / NRRL 194 / M139) (Aspergillus nidulans) (see 2 papers)
42% identity, 80% coverage: 72:360/363 of query aligns to 78:391/1583 of P07547
Sites not aligning to the query:
1nvbB Crystal structure of 3-dehydroquinate synthase (dhqs) in complex with zn2+ and carbaphosphonate (see paper)
42% identity, 80% coverage: 72:360/363 of query aligns to 76:389/391 of 1nvbB
- active site: R128 (= R122), K150 (= K144), E192 (= E186), K248 (= K230), E258 (= E240), R262 (= R244), N266 (= N248), H269 (= H251), H273 (= H255), H285 (= H268)
- binding [1r-(1alpha,3beta,4alpha,5beta)]-5-(phosphonomethyl)-1,3,4-trihydroxycyclohexane-1-carboxylic acid: D144 (= D138), K150 (= K144), N160 (= N154), E192 (= E186), K248 (= K230), R262 (= R244), L265 (= L247), N266 (= N248), H269 (= H251), H273 (= H255), K354 (= K327)
- binding zinc ion: E192 (= E186), H269 (= H251), H285 (= H268)
3qbeA Crystal structure of the 3-dehydroquinate synthase (arob) from mycobacterium tuberculosis
41% identity, 83% coverage: 38:338/363 of query aligns to 34:325/352 of 3qbeA
- active site: R117 (= R122), K139 (= K144), E181 (= E186), K223 (= K230), R233 (= R244), N237 (= N248), H240 (= H251), H244 (= H255), H256 (= H268)
- binding zinc ion: E181 (= E186), H240 (= H251), H256 (= H268)
3qbdA 3-dehydroquinate synthase (arob) from mycobacterium tuberculosis in complex with NAD
40% identity, 83% coverage: 38:338/363 of query aligns to 34:317/344 of 3qbdA
- active site: R117 (= R122), K139 (= K144), E181 (= E186), K223 (= K230), R232 (= R244), N236 (= N248), H239 (= H251), H243 (= H255), H255 (= H268)
- binding nicotinamide-adenine-dinucleotide: Q40 (≠ N44), D68 (≠ P73), A69 (≠ G74), E70 (= E75), K73 (= K78), G101 (= G106), G102 (= G107), A103 (≠ V108), D106 (= D111), T126 (= T131), T127 (= T132), L129 (= L134), A134 (≠ S139), T169 (= T174), L170 (= L175)
1nvaA Crystal structure of 3-dehydroquinate synthase (dhqs) in complex with zn2+ and adp (see paper)
45% identity, 66% coverage: 72:310/363 of query aligns to 75:322/380 of 1nvaA
- active site: R127 (= R122), K149 (= K144), E191 (= E186), K247 (= K230), R257 (= R244), N261 (= N248), H264 (= H251), H268 (= H255), H280 (= H268)
- binding adenosine-5'-diphosphate: G111 (= G106), G112 (= G107), T136 (= T131), T137 (= T132), F176 (≠ V171), T179 (= T174), L180 (= L175)
- binding zinc ion: E191 (= E186), H264 (= H251), H280 (= H268)
Sites not aligning to the query:
Query Sequence
>WP_012411972.1 NCBI__GCF_000020025.1:WP_012411972.1
MTSLINVNLPEQSYEIAIAPSNLDQLGQQMANLKLGKKVLLVSNPTIFKHYGERAITSLK
SAGFEVASCTLPPGERYKNLNSIQKLYDVALENRLERSATMVALGGGVIGDMTGFAAATW
LRGINVVQVPTTLLAMVDSAIGGKTGVNHPHGKNLIGAFHQPRLVLIDPDVLKTLPMREF
RAGMAEVIKYGVIWDAELFAQLEASKRLDQLRYVKPELIDSILTRSCQAKADVVGKDEKE
GGLRAILNYGHTIGHAVESLTGYRLVNHGEAVAIGMVAAGQIAVELGMWQKEDTERQNAL
IQKTGLPTQLPSGVDIEAIIDALQLDKKVKAGKVRFVLPTEIGVVTVTDEVPSDIIRQVL
QGM
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SitesBLAST's Database
SitesBLAST's database includes
(1) SwissProt
entries with experimentally-supported functional features;
and (2) protein structures with bound ligands, from the
BioLip database.
by Morgan Price,
Arkin group
Lawrence Berkeley National Laboratory