SitesBLAST
Comparing WP_011372650.1 NCBI__GCF_000012965.1:WP_011372650.1 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)
P56081 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacter pylori) (see paper)
53% identity, 96% coverage: 12:346/349 of query aligns to 10:342/343 of P56081
3clhA Crystal structure of 3-dehydroquinate synthase (dhqs)from helicobacter pylori (see paper)
48% identity, 96% coverage: 12:346/349 of query aligns to 7:307/308 of 3clhA
- active site: R107 (= R112), K129 (= K134), E171 (= E176), K207 (= K214), R212 (= R228), N216 (= N232), H219 (= H235), H223 (= H239), H236 (= H252)
- binding nicotinamide-adenine-dinucleotide: I33 (≠ T38), V34 (≠ I39), H38 (= H43), S58 (≠ D63), E60 (= E65), K63 (= K68), G91 (= G96), G92 (= G97), V93 (= V98), D96 (= D101), T116 (= T121), T117 (= T122), L119 (= L124), D123 (= D128), A124 (= A129), K129 (= K134), N139 (= N144), T159 (= T164), L160 (= L165), E164 (= E169)
3zokA Structure of 3-dehydroquinate synthase from actinidia chinensis in complex with NAD (see paper)
44% identity, 97% coverage: 12:349/349 of query aligns to 10:365/365 of 3zokA
- active site: R122 (= R112), K144 (= K134), E186 (= E176), K228 (= K214), E238 (= E224), R242 (= R228), N246 (= N232), H249 (= H235), H253 (= H239), H266 (= H252)
- binding glycine: K144 (= K134), K228 (= K214), R242 (= R228)
- binding nicotinamide-adenine-dinucleotide: T44 (= T38), V45 (≠ I39), D73 (= D63), E75 (= E65), K78 (= K68), G106 (= G96), G107 (= G97), V108 (= V98), D111 (= D101), T131 (= T121), T132 (= T122), M134 (≠ L124), D138 (= D128), S139 (≠ A129), K144 (= K134), K153 (= K143), T174 (= T164), L175 (= L165), E179 (= E169), H266 (= H252)
U3KRF2 3-dehydroquinate synthase, chloroplastic; EC 4.2.3.4 from Actinidia chinensis var. chinensis (Chinese soft-hair kiwi) (see paper)
44% identity, 97% coverage: 12:349/349 of query aligns to 90:445/445 of U3KRF2
Q9KNV2 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Vibrio cholerae serotype O1 (strain ATCC 39315 / El Tor Inaba N16961)
43% identity, 94% coverage: 12:339/349 of query aligns to 10:351/361 of Q9KNV2
3okfA 2.5 angstrom resolution crystal structure of 3-dehydroquinate synthase (arob) from vibrio cholerae
43% identity, 94% coverage: 12:339/349 of query aligns to 11:350/360 of 3okfA
- active site: R120 (= R112), K142 (= K134), E184 (= E176), K226 (= K214), R238 (= R228), N242 (= N232), H245 (= H235), H249 (= H239), H262 (= H252)
- binding nicotinamide-adenine-dinucleotide: N42 (= N36), L48 (= L42), D71 (= D63), E73 (= E65), K76 (= K68), G104 (= G96), G105 (= G97), V106 (= V98), D109 (= D101), T129 (= T121), T130 (= T122), L132 (= L124), D136 (= D128), T172 (= T164), L173 (= L165), E177 (= E169)
Q5NFS1 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4)
46% identity, 86% coverage: 28:328/349 of query aligns to 34:341/359 of Q5NFS1
5eksA Structure of 3-dehydroquinate synthase from acinetobacter baumannii in complex with NAD
40% identity, 95% coverage: 3:335/349 of query aligns to 5:341/355 of 5eksA
- active site: R120 (= R112), K142 (= K134), E184 (= E176), K226 (= K214), R237 (= R228), N241 (= N232), H244 (= H235), H248 (= H239), H261 (= H252)
- binding magnesium ion: E184 (= E176), H244 (= H235), H261 (= H252)
- binding nicotinamide-adenine-dinucleotide: N42 (= N36), V45 (≠ I39), D71 (= D63), E73 (= E65), K76 (= K68), G104 (= G96), G105 (= G97), V106 (= V98), D109 (= D101), T129 (= T121), T130 (= T122), D136 (= D128), S137 (≠ A129), K142 (= K134), T172 (= T164), L173 (= L165), E177 (= E169)
5hvnA 3.0 angstrom crystal structure of 3-dehydroquinate synthase (arob) from francisella tularensis in complex with NAD.
45% identity, 86% coverage: 28:328/349 of query aligns to 37:336/354 of 5hvnA
- active site: R123 (= R112), K145 (= K134), E187 (= E176), K228 (= K214), R239 (= R228), N243 (= N232), H246 (= H235), H250 (= H239), H263 (= H252)
- binding nicotinamide-adenine-dinucleotide: N45 (= N36), L51 (= L42), D73 (= D63), E75 (= E65), K78 (= K68), G107 (= G96), G108 (= G97), V109 (= V98), D112 (= D101), T132 (= T121), T133 (= T122), L135 (= L124), D139 (= D128), K145 (= K134), F172 (= F161), T175 (= T164), L176 (= L165), E180 (= E169)
6llaB Crystal structure of providencia alcalifaciens 3-dehydroquinate synthase (dhqs) in complex with mg2+ and NAD (see paper)
42% identity, 90% coverage: 30:344/349 of query aligns to 37:359/363 of 6llaB
- active site: R121 (= R112), K143 (= K134), E185 (= E176), K227 (= K214), E237 (= E224), R242 (= R228), N246 (= N232), H249 (= H235), H253 (= H239), H266 (= H252)
- binding magnesium ion: E185 (= E176), H249 (= H235), H266 (= H252)
- binding nicotinamide-adenine-dinucleotide: L46 (≠ I39), D72 (= D63), E74 (= E65), K77 (= K68), G105 (= G96), G106 (= G97), V107 (= V98), D110 (= D101), T130 (= T121), T131 (= T122), L133 (= L124), D137 (= D128), K143 (= K134), T173 (= T164), L174 (= L165), E178 (= E169)
6lk2A Crystal structure of providencia alcalifaciens 3-dehydroquinate synthase (dhqs) in complex with mg2+, NAD and chlorogenic acid (see paper)
42% identity, 90% coverage: 30:344/349 of query aligns to 37:355/357 of 6lk2A
- active site: R121 (= R112), K143 (= K134), E185 (= E176), K227 (= K214), R238 (= R228), N242 (= N232), H245 (= H235), H249 (= H239), H262 (= H252)
- binding (1R,3R,4S,5R)-3-[3-[3,4-bis(oxidanyl)phenyl]propanoyloxy]-1,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid: D137 (= D128), E185 (= E176), K227 (= K214), R238 (= R228), N242 (= N232), H245 (= H235), T246 (= T236), H249 (= H239), H262 (= H252)
- binding magnesium ion: E185 (= E176), H245 (= H235), H262 (= H252)
- binding nicotinamide-adenine-dinucleotide: L46 (≠ I39), D72 (= D63), E74 (= E65), K77 (= K68), G105 (= G96), G106 (= G97), V107 (= V98), D110 (= D101), T130 (= T121), T131 (= T122), L133 (= L124), D137 (= D128), S138 (≠ A129), C170 (≠ F161), T173 (= T164), L174 (= L165), P175 (= P166), E178 (= E169)
6hqvA Pentafunctional arom complex from chaetomium thermophilum (see paper)
41% identity, 68% coverage: 55:293/349 of query aligns to 66:321/1555 of 6hqvA
- active site: R123 (= R112), K145 (= K134), E187 (= E176), K243 (= K214), E253 (= E224), R257 (= R228), N261 (= N232), H264 (= H235), H268 (= H239), H280 (= H252)
- binding glutamic acid: D139 (= D128), K145 (= K134), E187 (= E176), K243 (= K214), R257 (= R228), H264 (= H235), H280 (= H252)
- binding nicotinamide-adenine-dinucleotide: E76 (= E65), K79 (= K68), G107 (= G96), G108 (= G97), V109 (= V98), D112 (= D101), T132 (= T121), T133 (= T122), L135 (= L124), D139 (= D128), S140 (≠ A129), K145 (= K134), K154 (= K143), T175 (= T164), L176 (= L165), P177 (= P166), E180 (= E169), H280 (= H252)
- binding zinc ion: E187 (= E176), H264 (= H235), H280 (= H252)
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
P9WPX9 3-dehydroquinate synthase; DHQS; EC 4.2.3.4 from Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
36% identity, 91% coverage: 5:321/349 of query aligns to 8:334/362 of P9WPX9
1dqsA Crystal structure of dehydroquinate synthase (dhqs) complexed with carbaphosphonate, NAD+ and zn2+ (see paper)
41% identity, 68% coverage: 64:300/349 of query aligns to 77:323/381 of 1dqsA
- active site: R127 (= R112), K149 (= K134), E191 (= E176), K240 (= K214), E250 (= E224), R254 (= R228), N258 (= N232), H261 (= H235), H265 (= H239), H277 (= H252)
- binding [1r-(1alpha,3beta,4alpha,5beta)]-5-(phosphonomethyl)-1,3,4-trihydroxycyclohexane-1-carboxylic acid: D143 (= D128), K149 (= K134), N159 (= N144), E191 (= E176), K240 (= K214), R254 (= R228), L257 (= L231), N258 (= N232), H261 (= H235), H265 (= H239), H277 (= H252)
- binding nicotinamide-adenine-dinucleotide: E78 (= E65), K81 (= K68), G111 (= G96), G112 (= G97), V113 (= V98), D116 (= D101), T136 (= T121), T137 (= T122), L139 (= L124), D143 (= D128), S144 (≠ A129), K158 (= K143), T179 (= T164), P181 (= P166), E184 (= E169), H277 (= H252)
- binding zinc ion: E191 (= E176), H261 (= H235), H277 (= H252)
Sites not aligning to the query:
3qbeA Crystal structure of the 3-dehydroquinate synthase (arob) from mycobacterium tuberculosis
35% identity, 91% coverage: 5:321/349 of query aligns to 3:325/352 of 3qbeA
- active site: R117 (= R112), K139 (= K134), E181 (= E176), K223 (= K214), R233 (= R228), N237 (= N232), H240 (= H235), H244 (= H239), H256 (= H252)
- binding zinc ion: E181 (= E176), H240 (= H235), H256 (= H252)
1nvbB Crystal structure of 3-dehydroquinate synthase (dhqs) in complex with zn2+ and carbaphosphonate (see paper)
40% identity, 68% coverage: 64:300/349 of query aligns to 78:331/391 of 1nvbB
- active site: R128 (= R112), K150 (= K134), E192 (= E176), K248 (= K214), E258 (= E224), R262 (= R228), N266 (= N232), H269 (= H235), H273 (= H239), H285 (= H252)
- binding [1r-(1alpha,3beta,4alpha,5beta)]-5-(phosphonomethyl)-1,3,4-trihydroxycyclohexane-1-carboxylic acid: D144 (= D128), K150 (= K134), N160 (= N144), E192 (= E176), K248 (= K214), R262 (= R228), L265 (= L231), N266 (= N232), H269 (= H235), H273 (= H239)
- binding zinc ion: E192 (= E176), H269 (= H235), H285 (= H252)
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)
37% identity, 78% coverage: 29:300/349 of query aligns to 37:333/1583 of P07547
- DTN 44:46 (≠ NST 36:38) binding NAD(+)
- EVSK 81:84 (≠ EEYK 65:68) binding NAD(+)
- GGV 114:116 (= GGV 96:98) binding NAD(+)
- D119 (= D101) binding NAD(+)
- TT 139:140 (= TT 121:122) binding NAD(+)
- K161 (= K143) binding NAD(+)
- FLET 179:182 (≠ FLTT 161:164) binding NAD(+)
- N190 (≠ A172) binding NAD(+)
- E194 (= E176) binding Zn(2+)
- H271 (= H235) binding Zn(2+)
- H287 (= H252) binding Zn(2+)
6c5cA Crystal structure of the 3-dehydroquinate synthase (dhqs) domain of aro1 from candida albicans sc5314 in complex with nadh (see paper)
38% identity, 71% coverage: 47:293/349 of query aligns to 65:322/385 of 6c5cA
- active site: R130 (= R112), K152 (= K134), E194 (= E176), K246 (= K214), E254 (= E224), R258 (= R228), N262 (= N232), H265 (= H235), H269 (= H239), H281 (= H252)
- binding nicotinamide-adenine-dinucleotide: E83 (= E65), K86 (= K68), G114 (= G96), G115 (= G97), V116 (= V98), D119 (= D101), T139 (= T121), T140 (= T122), D146 (= D128), S147 (≠ A129), F179 (= F161), T182 (= T164), L183 (= L165), Q187 (≠ E169)
Sites not aligning to the query:
3qbdA 3-dehydroquinate synthase (arob) from mycobacterium tuberculosis in complex with NAD
36% identity, 83% coverage: 5:294/349 of query aligns to 3:297/344 of 3qbdA
- active site: R117 (= R112), K139 (= K134), E181 (= E176), K223 (= K214), R232 (= R228), N236 (= N232), H239 (= H235), H243 (= H239), H255 (= H252)
- binding nicotinamide-adenine-dinucleotide: Q40 (≠ N36), D68 (= D63), A69 (≠ G64), E70 (= E65), K73 (= K68), G101 (= G96), G102 (= G97), A103 (≠ V98), D106 (= D101), T126 (= T121), T127 (= T122), L129 (= L124), A134 (= A129), T169 (= T164), L170 (= L165)
1nvaA Crystal structure of 3-dehydroquinate synthase (dhqs) in complex with zn2+ and adp (see paper)
39% identity, 68% coverage: 64:300/349 of query aligns to 77:326/380 of 1nvaA
- active site: R127 (= R112), K149 (= K134), E191 (= E176), K247 (= K214), R257 (= R228), N261 (= N232), H264 (= H235), H268 (= H239), H280 (= H252)
- binding adenosine-5'-diphosphate: G111 (= G96), G112 (= G97), T136 (= T121), T137 (= T122), F176 (= F161), T179 (= T164), L180 (= L165)
- binding zinc ion: E191 (= E176), H264 (= H235), H280 (= H252)
Sites not aligning to the query:
Query Sequence
>WP_011372650.1 NCBI__GCF_000012965.1:WP_011372650.1
MQVHIELKKVVDNSYDITIGTLPTLHFDTKVAVVTNSTISALHLEYLLSKISAKELYVVT
LRDGEEYKNQQSIDTILEALFENRFNRKSMIIAFGGGVIGDMSGYAASIYQRGIDFIQIP
TTLLSQVDASVGGKTGMNNRYGKNLVGAFHQPRAVYIDPHFLTTLPPREFGAGVAEIVKM
AVTFDKDFFEFLERADLSKPEILQEAIKKALQTKAKVVTQDEKEQGIRAALNYGHTFGHV
VENETAYKEFLHGEAVAIGMVMANEMAIKMNYMFEKEALRVKALLQKYNLPTTYAIKDVK
AFYEAFFLDKKSSDSAITFILPLGIGDVVITDKVDTGTIMCVLNKFGKQ
Or try a new SitesBLAST search
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